SCHEMBL14115083

SCHEMBL14115083

CCc1nc(Cl)nc2cc(OC)c(OC)cc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 5/20 0.51
ALDH1A1 P00352 3/20 0.51
TNF P01375 1/20 0.48
KDR P35968 6/20 0.48
EGFR P00533 6/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
MAPT P10636 1/20 0.46
EHMT2 Q96KQ7 1/20 0.45
PLK4 O00444 1/20 0.44
CHEK1 O14757 1/20 0.44
AURKA O14965 1/20 0.44
NTRK1 P04629 1/20 0.44
LCK P06239 1/20 0.44
CDK1 P06493 1/20 0.44
CSF1R P07333 1/20 0.44
PIM1 P11309 1/20 0.44
RPS6KB1 P23443 1/20 0.44
CDK2 P24941 1/20 0.44

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
SCHEMBL14115009 0.88 EGFR (0.47) HTTSMN1; SMN2ALDH1A1TNFKDR
SCHEMBL25680896 0.81 NTSR1 (0.50) HTTSMN1; SMN2ALDH1A1KDRKDM4E
SCHEMBL294809 0.79 SMN1; SMN2 (0.56) HTTSMN1; SMN2ALDH1A1TNFKDR
SCHEMBL29532044 0.79 SMN1; SMN2 (0.56) HTTSMN1; SMN2ALDH1A1TNFKDR
SCHEMBL11320298 0.77 SMN1; SMN2 (0.55) HTTSMN1; SMN2ALDH1A1TNFKDR
SCHEMBL3318468 0.77 SMN1; SMN2 (0.55) HTTSMN1; SMN2ALDH1A1TNFKDR
SCHEMBL16521332 0.77 SMN1; SMN2 (0.52) HTTSMN1; SMN2ALDH1A1KDREGFR
Propanol SCHEMBL28411721 0.76 HTT (0.60) HTTSMN1; SMN2ALDH1A1TNFKDR
SCHEMBL30636665 0.76 EGFR (0.57) HTTSMN1; SMN2ALDH1A1TNFKDR
SCHEMBL2171367 0.76 EGFR (0.57) HTTSMN1; SMN2ALDH1A1TNFKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160243085-A1 SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS MIDCAP FINANCIAL TRUST 2016-08-25 US disclosed
US-20080188474-A1 e.g. 1-phenyl-N3-(4-(2-(piperidin-1-yl)ethoxy)phenyl)-1H-1,2,4-triazole-3,5-diamine; receptor protein tyrosine kinase (AXL) antagonist; antiinflammatory, anticarcinogenic , antidiabetic agent; rheumatoid arthritis, vascular disease; breast, renal, endometrial, ovarian carcinoma, or myeloid leukemia RIGEL PHARMACEUTICALS, INC. (US) 2008-08-07 US disclosed
WO-2007144699-A2 PROCESS FOR THE PREPARATION OF ALFUZOSIN TORRENT PHARMACEUTICALS LIMITED (US) 2007-12-21 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-20160243085-A1 SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS AXL, TYRO3, MERTK HTT 3161/4885SMN1; SMN2 3354/4885ALDH1A1 4309/4885
US-20080188474-A1 e.g. 1-phenyl-N3-(4-(2-(piperidin-1-yl)ethoxy)phenyl)-1H-1,2,4-triazole-3,5-diamine; receptor protein tyrosine kinase (AXL) antagonist; antiinflammatory, anticarcinogenic , antidiabetic agent; rheumatoid arthritis, vascular disease; breast, renal, endometrial, ovarian carcinoma, or myeloid leukemia AXL, TYRO3, FLT3 HTT 3222/4885SMN1; SMN2 4804/4885ALDH1A1 2732/4885

“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.