SCHEMBL3701869

SCHEMBL3701869

COc1ccc(Cl)cc1NC(=O)Nc1cccc2c1ccn2Cc1ccnc2c1ccn2C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 4/20 0.41
EPHB4 P54760 3/20 0.41
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
POLB P06746 3/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
MAPT P10636 4/20 0.40
KDM4E B2RXH2 2/20 0.40
TP53 P04637 1/20 0.39
LMNA P02545 1/20 0.39
ALOX12 P18054 1/20 0.39

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
SCHEMBL3700867 0.92 IGF1R (0.46) IGF1REPHB4KMT2AMEN1POLB
SCHEMBL4569777 0.84 AKT1 (0.38) KMT2AMEN1MAPTKDM4E
SCHEMBL3712537 0.84 MEN1 (0.46) KMT2AMEN1POLBMAPTKDM4E
SCHEMBL3695866 0.83 ALDH1A1 (0.42) IGF1REPHB4KMT2AMEN1POLB
SCHEMBL4569774 0.83 IGF1R (0.42) IGF1REPHB4KMT2AMEN1POLB
SCHEMBL3701028 0.82 FPR2 (0.41) KMT2AMEN1MAPTKDM4ELMNA
SCHEMBL3712376 0.82 MEN1 (0.45) IGF1REPHB4KMT2AMEN1POLB
Hydrochloric Acid SCHEMBL3710728 0.82 MEN1 (0.44) IGF1REPHB4KMT2AMEN1POLB
SCHEMBL3704487 0.81 TRPV1 (0.42) KMT2AMEN1MAPT
SCHEMBL5592761 0.80 KMT2A (0.49) IGF1REPHB4KMT2AMEN1POLB

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 4 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 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

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 IGF1R 41/4885EPHB4 33/4885KMT2A 1244/4885

“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.