SCHEMBL3712376

SCHEMBL3712376

COc1ccc(Cl)cc1NC(=O)Nc1cccc2c1ccn2Cc1ccnc2[nH]ccc12

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
POLB P06746 3/20 0.45
IGF1R P08069 4/20 0.44
EPHB4 P54760 3/20 0.43
KDM4E B2RXH2 2/20 0.42
S1PR2 O95136 1/20 0.42
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41
TP53 P04637 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
Hydrochloric Acid SCHEMBL3710728 0.99 MEN1 (0.44) MEN1KMT2APOLBIGF1REPHB4
SCHEMBL15053581 0.92 MEN1 (0.44) MEN1KMT2APOLBIGF1REPHB4
Hydrochloric Acid SCHEMBL15053468 0.91 MEN1 (0.43) MEN1KMT2APOLBIGF1REPHB4
SCHEMBL3700209 0.91 PKM (0.44) MEN1KMT2APOLBEPHB4KDM4E
SCHEMBL3700898 0.91 MEN1 (0.48) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL3698259 0.90 MAPT (0.41) MEN1KMT2AKDM4EMAPTIRAK4
SCHEMBL3702950 0.90 KDR (0.42) MEN1KMT2AEPHB4KDM4EMAPT
SCHEMBL3702895 0.90 MAPT (0.46) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL27828001 0.89 TRPV1 (0.46) MEN1KMT2APOLBEPHB4MAPT
Hydrochloric Acid SCHEMBL3708512 0.89 MAPT (0.45) KDM4EMAPTLMNATP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8648086-B2 5,6-bicyclic heteroaryl-containing urea compounds as kinase inhibitors ASCEPION PHARMACEUTICALS, INC. (CN) 2014-02-11 US claimed
US-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS JIANG, SHAN 2012-05-17 US claimed
US-8648086-B2 5,6-bicyclic heteroaryl-containing urea compounds as kinase inhibitors ASCEPION PHARMACEUTICALS, INC. (CN) 2014-02-11 US disclosed
US-8648086-B2 5,6-bicyclic heteroaryl-containing urea compounds as kinase inhibitors ASCEPION PHARMACEUTICALS, INC. (CN) 2014-02-11 US disclosed
US-8648086-B2 5,6-bicyclic heteroaryl-containing urea compounds as kinase inhibitors ASCEPION PHARMACEUTICALS, INC. (CN) 2014-02-11 US disclosed
US-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS JIANG, SHAN 2012-05-17 US disclosed
US-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS JIANG, SHAN 2012-05-17 US disclosed
US-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS JIANG, SHAN 2012-05-17 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-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS FLT3, CSF1R, EPHA2 MEN1 1556/4885KMT2A 1244/4885POLB 3719/4885

“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.