SCHEMBL17673133

SCHEMBL17673133

COC(=O)c1cccc(N)c1NC(C)CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
HSD17B10 Q99714 4/20 0.50
CFTR P13569 1/20 0.50
KDM4E B2RXH2 5/20 0.42
LMNA P02545 3/20 0.41
MAPT P10636 4/20 0.38
GAA P10253 3/20 0.38
HPGD P15428 3/20 0.38
TSHR P16473 2/20 0.38
ALOX15 P16050 2/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GLA P06280 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
ATM Q13315 1/20 0.37
CA1 P00915 1/20 0.36

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
SCHEMBL17673278 0.80 ALDH1A1 (0.45) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL17673293 0.80 ALDH1A1 (0.45) ALDH1A1KDM4EMAPTTSHRMAPK1
Methyl Anthranilate SCHEMBL27536718 0.76 ALDH1A1 (0.68) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL11446940 0.76 ALDH1A1 (0.64) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL2085084 0.75 ALDH1A1 (0.65) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL1052977 0.72 ALDH1A1 (0.53) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL9266151 0.72 ALDH1A1 (0.60) ALDH1A1HSD17B10CFTRKDM4EMAPT
SCHEMBL28451153 0.72 ALDH1A1 (0.57) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL3672546 0.71 KDM4E (0.59) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL30993253 0.71 KDM4E (0.38) ALDH1A1HSD17B10KDM4ELMNAMAPT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108512-B Therapeutic compounds and uses thereof 基因泰克公司 2021-05-04 CN disclosed
EP-3204360-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2020-08-26 EP disclosed
US-10206931-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-19 US disclosed
US-10206931-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-19 US disclosed
US-20170312292-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF WUXI APPTEC (SHANGHAI) CO. LTD (CN) 2017-11-02 US disclosed
US-20170312292-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF WUXI APPTEC (SHANGHAI) CO. LTD (CN) 2017-11-02 US disclosed
US-20170312292-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF WUXI APPTEC (SHANGHAI) CO. LTD (CN) 2017-11-02 US disclosed
CN-107108512-A Therapeutic compound and application thereof 基因泰克公司 2017-08-29 CN disclosed
EP-3204360-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF Genentech, Inc. (US) 2017-08-16 EP disclosed
WO-2016055028-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-04-14 WO 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 (2 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-20170312292-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, CREBBP, HDAC1 ALDH1A1 1533/4885HSD17B10 1022/4885CFTR 109/4885
US-10206931-B2 Therapeutic compounds and uses thereof EP300, CREBBP, HDAC1 ALDH1A1 1533/4885HSD17B10 1022/4885CFTR 109/4885

“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.