SCHEMBL30468945

SCHEMBL30468945

Cc1ccc2cc(C(=O)NC3CCN(C)CC3)ncc2n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 2/20 0.46
ABL1 P00519 2/20 0.45
SMYD3 Q9H7B4 3/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CHRNB2 P17787 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA4 P43681 1/20 0.43
HPGDS O60760 3/20 0.42
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
WNT1 P04628 1/20 0.41
GSK3B P49841 1/20 0.41
DYRK1A Q13627 1/20 0.41
CHRNA7 P36544 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
SCHEMBL30227653 0.84 ALDH1A1 (0.48) SSTR4SMYD3KDM4EALDH1A1HPGD
SCHEMBL24151463 0.76 GRM5 (0.53) SSTR4ALDH1A1CHRNB2CHRNB4CHRNA3
SCHEMBL2990215 0.74 PRKAB2 (0.50) SMYD3ALDH1A1CHRNB2CHRNB4CHRNA3
SCHEMBL26944377 0.74 HDAC6 (0.53) KDM4EHPGDSAURKAAURKB
SCHEMBL4251854 0.73 PRKAB2 (0.49) SSTR4SMYD3KDM4EALDH1A1CHRNB2
SCHEMBL16038662 0.72 GRM5 (0.49) SSTR4ABL1SMYD3CHRNB2CHRNB4
SCHEMBL23882445 0.70 CCNT1 (0.44) KDM4EHPGDSGSK3BDYRK1A
SCHEMBL29923773 0.70 KMT2A (0.47) SSTR4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL22725148 0.70 SMYD3 (0.49) SMYD3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL25053100 0.70 GRM5 (0.63) SSTR4SMYD3KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203029-A1 NAPHTHYRIDINE COMPOUNDS AS INHIBITORS OF MER TYROSINE KINASE AND AXL TYROSINE KINASE EVOTEC (UK) LIMITED (GB) 2023-06-29 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-20230203029-A1 NAPHTHYRIDINE COMPOUNDS AS INHIBITORS OF MER TYROSINE KINASE AND AXL TYROSINE KINASE MERTK, AXL, TYRO3 SSTR4 1765/4885ABL1 7/4885SMYD3 3473/4885

“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.