SCHEMBL17404497

SCHEMBL17404497

CC(C)(C)c1cccc(NC(=O)C2CCC2)c1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.68
NPSR1 Q6W5P4 1/20 0.62
ALDH1A1 P00352 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.58
LMNA P02545 1/20 0.56
KDM4E B2RXH2 1/20 0.54
HPGD P15428 1/20 0.54
BRAF P15056 1/20 0.54
GAA P10253 1/20 0.54
KCNK3 O14649 1/20 0.53
KCNK9 Q9NPC2 1/20 0.53
HDAC3 O15379 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13762199 0.97 RXFP1 (0.72) RXFP1NPSR1ALDH1A1SMN1; SMN2LMNA
SCHEMBL13155070 0.94 RXFP1 (0.64) RXFP1NPSR1ALDH1A1SMN1; SMN2LMNA
SCHEMBL24016844 0.86 RXFP1 (0.59) RXFP1NPSR1ALDH1A1SMN1; SMN2
SCHEMBL19887999 0.84 RXFP1 (0.54) RXFP1NPSR1ALDH1A1SMN1; SMN2LMNA
SCHEMBL17896347 0.82 ACKR3 (0.57) RXFP1NPSR1ALDH1A1KDM4EBRAF
SCHEMBL19638388 0.82 RXFP1 (0.73) RXFP1NPSR1ALDH1A1SMN1; SMN2LMNA
SCHEMBL15530072 0.82 RXFP1 (1.00) RXFP1ALDH1A1LMNA
SCHEMBL12975226 0.81 GAA (0.72) ALDH1A1LMNAHPGDGAA
SCHEMBL25389220 0.81 RXFP1 (0.74) RXFP1NPSR1ALDH1A1LMNAKDM4E
SCHEMBL2239100 0.81 RXFP1 (0.74) RXFP1NPSR1ALDH1A1LMNAKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210214323-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2021-07-15 US disclosed
US-10800750-B2 Compounds and compositions for inhibition of FASN FORMA THERAPEUTICS, INC. (US) 2020-10-13 US disclosed
US-10472342-B2 Compounds and compositions for inhibition of FASN FORMA THERAPEUTICS, INC. (US) 2019-11-12 US disclosed
US-10457655-B2 Compounds and compositions for inhibition of FASN FORMA THERAPEUTICS, INC. (US) 2019-10-29 US disclosed
US-10450286-B2 Compounds and compositions for inhibition of FASN FORMA THERAPEUTICS, INC. (US) 2019-10-22 US disclosed
US-10399951-B2 Compounds and compositions for inhibition of FASN FORMA THERAPEUTICS, INC. (US) 2019-09-03 US disclosed
US-20190241532-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2019-08-08 US disclosed
US-20190241533-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2019-08-08 US disclosed
US-20180050997-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2018-02-22 US disclosed
US-20180050997-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2018-02-22 US disclosed
US-9855269-B2 Aminoquinazoline and pyridopyrimidine derivatives GENENTECH, INC. (US) 2018-01-02 US disclosed
US-20170312273-A1 METHODS OF USING FASN INHIBITORS FORMA THERAPEUTICS, INC. 2017-11-02 US disclosed
US-20170312273-A1 METHODS OF USING FASN INHIBITORS FORMA THERAPEUTICS, INC. 2017-11-02 US disclosed
US-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES GENENTECH, INC. (US) 2017-06-22 US disclosed
US-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES GENENTECH, INC. (US) 2017-06-22 US disclosed
US-9592235-B2 Aminoquinazoline and pyridopyrimidine derivatives GENENTECH, INC. (US) 2017-03-14 US disclosed
US-9592235-B2 Aminoquinazoline and pyridopyrimidine derivatives GENENTECH, INC. (US) 2017-03-14 US disclosed
US-20160296525-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES GENENTECH, INC. (US) 2016-10-13 US disclosed
US-9382241-B2 Aminoquinazoline and pyridopyrimidine derivatives GENENTECH, INC. (US) 2016-07-05 US disclosed
US-20160002188-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FORMA THERAPEUTICS, INC. 2016-01-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190241533-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FASN, FABP1, SCD RXFP1 4584/4885NPSR1 2115/4885ALDH1A1 1643/4885
US-20180050997-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FASN, FABP1, SCD RXFP1 4584/4885NPSR1 2115/4885ALDH1A1 1643/4885
US-10399951-B2 Compounds and compositions for inhibition of FASN FASN, FABP1, SCD RXFP1 4659/4885NPSR1 2002/4885ALDH1A1 1238/4885
US-20160296525-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES DPYD, FANCD2, RECQL RXFP1 1855/4885NPSR1 3367/4885ALDH1A1 534/4885
US-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES FLT4, FLT1, KDR RXFP1 135/4885NPSR1 2176/4885ALDH1A1 586/4885
US-20170312273-A1 METHODS OF USING FASN INHIBITORS FASN, IL1RN, CCR1 RXFP1 2255/4885NPSR1 1513/4885ALDH1A1 456/4885
US-10472342-B2 Compounds and compositions for inhibition of FASN FASN, FABP1, SCD RXFP1 4617/4885NPSR1 1940/4885ALDH1A1 1393/4885
US-10450286-B2 Compounds and compositions for inhibition of FASN FASN, FABP1, SCD RXFP1 4617/4885NPSR1 1940/4885ALDH1A1 1393/4885
US-20160002188-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FASN, FABP1, SCD RXFP1 4584/4885NPSR1 2115/4885ALDH1A1 1643/4885
US-20190241532-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FASN, FABP1, SCD RXFP1 4584/4885NPSR1 2115/4885ALDH1A1 1643/4885
US-20210214323-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR INHIBITION OF FASN FASN, FABP1, SCD RXFP1 4584/4885NPSR1 2115/4885ALDH1A1 1643/4885
US-10457655-B2 Compounds and compositions for inhibition of FASN FASN, FABP1, SCD RXFP1 4617/4885NPSR1 1940/4885ALDH1A1 1393/4885
US-10800750-B2 Compounds and compositions for inhibition of FASN FASN, FABP1, SCD RXFP1 4617/4885NPSR1 1940/4885ALDH1A1 1393/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.