SCHEMBL14739635

SCHEMBL14739635

Clc1ccc(-n2nnnc2-c2c(-c3cc(Cl)ccc3Cl)nc3cnccn23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 4/20 0.41
HTT P42858 2/20 0.41
GPR55 Q9Y2T6 1/20 0.41
P2RX7 Q99572 1/20 0.41
BRAF P15056 2/20 0.39
HSD17B10 Q99714 2/20 0.39
ALDH1A1 P00352 7/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 5/20 0.39
MAPT P10636 4/20 0.39
TP53 P04637 2/20 0.39
NPSR1 Q6W5P4 3/20 0.38
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 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
SCHEMBL14740335 0.85 LMNA (0.46) LMNAHTTGPR55HSD17B10ALDH1A1
SCHEMBL14740234 0.80 ALDH1A1 (0.43) L3MBTL1LMNAHTTGPR55P2RX7
SCHEMBL14740076 0.78 LMNA (0.43) L3MBTL1LMNAHTTGPR55P2RX7
SCHEMBL14740292 0.78 LMNA (0.40) L3MBTL1LMNAHTTGPR55HSD17B10
SCHEMBL18622355 0.78 NR1I3 (0.47) LMNAHSD17B10ALDH1A1
SCHEMBL14740449 0.78 NR1I3 (0.45) LMNAHTTHSD17B10ALDH1A1KDM4E
SCHEMBL14740306 0.78 NR1I3 (0.45) L3MBTL1LMNAHTTHSD17B10ALDH1A1
SCHEMBL14739184 0.77 ALDH1A1 (0.50) LMNAHTTGPR55HSD17B10ALDH1A1
SCHEMBL14740432 0.76 ALDH1A1 (0.47) L3MBTL1LMNAHTTGPR55HSD17B10
SCHEMBL14739995 0.73 ALDH1A1 (0.46) L3MBTL1LMNAHTTGPR55HSD17B10

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
US-9593109-B2 Bicyclic agonists of GPR131 and uses thereof CYMABAY THERAPEUTICS, INC. (US) 2017-03-14 US claimed
US-20130059845-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. 2013-03-07 US claimed
US-9593109-B2 Bicyclic agonists of GPR131 and uses thereof CYMABAY THERAPEUTICS, INC. (US) 2017-03-14 US disclosed
US-9593109-B2 Bicyclic agonists of GPR131 and uses thereof CYMABAY THERAPEUTICS, INC. (US) 2017-03-14 US disclosed
US-9593109-B2 Bicyclic agonists of GPR131 and uses thereof CYMABAY THERAPEUTICS, INC. (US) 2017-03-14 US disclosed
WO-2013032939-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. (US) 2013-03-07 WO disclosed
US-20130059845-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. 2013-03-07 US disclosed
WO-2013032939-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. (US) 2013-03-07 WO disclosed
US-20130059845-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. 2013-03-07 US disclosed
US-20130059845-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. 2013-03-07 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 (1 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-20130059845-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF GPR119, GPR88, GPR3 L3MBTL1 4645/4885LMNA 2636/4885HTT 3046/4885

“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.