SCHEMBL3547609

SCHEMBL3547609

CCCn1c(Cn2ccnc2-c2cccc(F)n2)nc2ccc(C(=O)NN)cc21

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAP3K7 O43318 1/20 0.37
GLP1R P43220 5/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ACSS2 Q9NR19 4/20 0.36
TP53 P04637 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NAMPT P43490 1/20 0.36
PDE2A O00408 1/20 0.36
PDE10A Q9Y233 1/20 0.36
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL3067526 0.93 MEN1 (0.38) MEN1KMT2AMAP3K7KDM4EALDH1A1
SCHEMBL3070367 0.90 ACSS2 (0.42) MEN1KMT2AGLP1RKDM4EACSS2
SCHEMBL3050434 0.88 ACSS2 (0.42) MEN1KMT2AGLP1RACSS2TP53
SCHEMBL13089648 0.86 MAPK10 (0.40) MEN1KMT2AKDM4EALDH1A1RXFP1
SCHEMBL13010691 0.85 MEN1 (0.40) MEN1KMT2AKDM4EALDH1A1TP53
SCHEMBL13089664 0.85 CYP11B2 (0.39) MEN1KMT2AKDM4ETP53PDE2A
SCHEMBL3068679 0.84 GLP1R (0.40) KMT2AGLP1RACSS2HPGD
SCHEMBL3065708 0.83 CNR2 (0.40) MEN1KMT2AKDM4EALDH1A1RXFP1
SCHEMBL3054960 0.81 PTGER4 (0.39) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL3050550 0.81 MEN1 (0.48) MEN1KMT2AKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642267-B2 Benzimidazole and pyridylimidazole derivatives NEUROGEN CORPORATION (US) 2010-01-05 US disclosed
US-20080227793-A1 Benzimidazole and Pyridylimidazole Derivatives NEUROGEN CORPORATION 2008-09-18 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-20080227793-A1 Benzimidazole and Pyridylimidazole Derivatives GABBR1, GABBR2, GABRA2 MEN1 3395/4885KMT2A 1769/4885MAP3K7 3481/4885

“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.