SCHEMBL293394

SCHEMBL293394

CCOC(=O)N1CC[CH]CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.57
ALDH1A1 P00352 4/20 0.55
POLB P06746 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HTT P42858 1/20 0.55
GAA P10253 5/20 0.52
RECQL P46063 1/20 0.52
MAPT P10636 3/20 0.51
ABL1 P00519 1/20 0.51
RIN1 Q13671 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
KDM4E B2RXH2 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
FAAH O00519 1/20 0.47
MGLL Q99685 1/20 0.47
THRB P10828 1/20 0.47
ATM Q13315 1/20 0.47

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
SCHEMBL1713325 0.92 TSHR (0.50) TSHRALDH1A1POLBSMN1; SMN2HTT
SCHEMBL4043953 0.92 RECQL (0.64) TSHRALDH1A1POLBSMN1; SMN2HTT
SCHEMBL1712987 0.88 TSHR (0.48) TSHRALDH1A1POLBSMN1; SMN2HTT
SCHEMBL1713264 0.88 TSHR (0.53) TSHRALDH1A1POLBSMN1; SMN2HTT
SCHEMBL1713157 0.86 POLB (0.49) TSHRALDH1A1POLBSMN1; SMN2HTT
SCHEMBL10985089 0.84 ALDH1A1 (0.72) TSHRALDH1A1POLBSMN1; SMN2HTT
SCHEMBL1684895 0.84
SCHEMBL574934 0.83 SMN1; SMN2 (0.63) TSHRALDH1A1POLBSMN1; SMN2HTT
SCHEMBL1713386 0.80 SMN1; SMN2 (0.40) TSHRALDH1A1POLBSMN1; SMN2HTT
SCHEMBL699214 0.80 KIT (0.44) TSHRALDH1A1POLBSMN1; SMN2HTT

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 446 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230416205-A1 COMPOUNDS, COMPOSITIONS, AND METHODS TENVIE THERAPEUTICS, INC. 2023-12-28 US claimed
EP-4247376-A1 COMPOUNDS, COMPOSITIONS, AND METHODS Denali Therapeutics Inc. (US) 2023-09-27 EP claimed
CN-116507608-A Compounds, compositions, and methods 戴纳立制药公司 2023-07-28 CN claimed
WO-2022109268-A1 COMPOUNDS, COMPOSITIONS, AND METHODS DENALI THERAPEUTICS INC. (US) 2022-05-27 WO claimed
US-9266835-B2 Quinoline derivatives useful as CB-1 inverse agonists JANSSEN PHARMACEUTICA NV (BE) 2016-02-23 US claimed
CN-105102446-A Modulators of methyl modifying enzymes, compositions and uses thereof CONSTELLATION PHARMACEUTICALS INC 2015-11-25 CN claimed
EP-2091926-B1 SUBSTITUTED PYRAZOLE AND TRIAZOLE COMPOUNDS AS KSP INHIBITORS NOVARTIS AG (CH) 2015-10-21 EP claimed
WO-2015130444-A1 QUINOLINE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2015-09-03 WO claimed
US-20150239844-A1 QUINOLINE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2015-08-27 US claimed
CN-103396412-A Modifier of 5-HT2A serotonin receptor ARENA PHARM INC 2013-11-20 CN claimed
US-5917043-A INTERMEDIATES SMITHKLINE BEECHAM CORPORATION (US) 1999-06-29 US claimed
EP-0912574-A1 BETA-LACTAMS F. HOFFMANN-LA ROCHE AG (CH) 1999-05-06 EP claimed
EP-0779888-B1 PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM BOEHRINGER INGELHEIM PHARMA (DE) 1999-04-28 EP claimed
US-5707989-A ANTITUMOR AGENTS, INHIBITING SIGNAL TRANSDUCTION MEDIATED BY TYROSINE KINASES DR. KARL THOMAE GMBH (DE) 1998-01-13 US claimed
WO-1997045429-A1 BETA-LACTAMS F. HOFFMANN-LA ROCHE AG (CH) 1997-12-04 WO claimed
CN-1157619-A Pyrimido [5-4-d] pyrimidines, drugs containing these compounds, their use and process for preparing them THOMAE GMBH DR K (DE) 1997-08-20 CN claimed
EP-0779888-A1 PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM Dr. Karl Thomae GmbH (DE) 1997-06-25 EP claimed
CN-1150950-A Cephalosporin derivatives HOFFMANN LA ROCHE (CH) 1997-06-04 CN claimed
EP-0761673-A1 Cephalosporin derivatives F. HOFFMANN-LA ROCHE AG (CH) 1997-03-12 EP claimed
WO-1996007657-A1 PYRIMIDO[5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM DR. KARL THOMAE GMBH (DE) 1996-03-14 WO claimed

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-20150239844-A1 QUINOLINE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS CNR1, CNR2, GPR119 TSHR 850/4885ALDH1A1 1204/4885POLB 3741/4885
US-20230416205-A1 COMPOUNDS, COMPOSITIONS, AND METHODS NLRP3, NLRP1, NOD1 TSHR 4226/4885ALDH1A1 4711/4885POLB 3627/4885

“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.