SCHEMBL8436859

SCHEMBL8436859

N#Cc1ccc(Cn2cncc2CCNC(=O)C2CCCN(S(=O)(=O)c3ccccc3)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FNTA P49354 9/20 0.55
FNTB P49356 9/20 0.55
PGGT1B P53609 8/20 0.55
LMNA P02545 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MAPK1 P28482 1/20 0.53
ALDH1A1 P00352 1/20 0.51
MEN1 O00255 1/20 0.50
PKM P14618 1/20 0.50
KMT2A Q03164 1/20 0.50
NPC1 O15118 1/20 0.49
CYP11B1 P15538 1/20 0.49
CYP11B2 P19099 1/20 0.49
KCNH2 Q12809 1/20 0.48

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
SCHEMBL6003187 1.00 FNTA (0.55) FNTAFNTBPGGT1BLMNASMN1; SMN2
SCHEMBL5298259 0.92 FNTA (0.51) FNTAFNTBPGGT1BLMNASMN1; SMN2
SCHEMBL8434426 0.92 FNTA (0.51) FNTAFNTBPGGT1BLMNASMN1; SMN2
SCHEMBL5285086 0.91 MAPK1 (0.48) FNTAFNTBPGGT1BLMNASMN1; SMN2
SCHEMBL7513048 0.91 MAPK1 (0.48) FNTAFNTBPGGT1BLMNASMN1; SMN2
SCHEMBL8104389 0.91 ALDH1A1 (0.57) FNTAFNTBPGGT1BALDH1A1CYP11B1
SCHEMBL8103587 0.91 ALDH1A1 (0.57) FNTAFNTBPGGT1BALDH1A1CYP11B1
SCHEMBL8423622 0.91 ALDH1A1 (0.57) FNTAFNTBPGGT1BALDH1A1CYP11B1
SCHEMBL8097870 0.90 CYP11B1 (0.53) FNTAFNTBPGGT1BALDH1A1KMT2A
SCHEMBL8534851 0.90 CYP11B1 (0.53) FNTAFNTBPGGT1BALDH1A1KMT2A

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
EP-0862435-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 1999-02-03 EP claimed
EP-0862435-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-09-09 EP claimed
WO-1997018813-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-05-29 WO claimed
US-5817678-A IMIDAZOLE-CONTAINING PIPERIDINE DERIVATIVES, PEPTIDEMIMETIC MERCK & CO., INC. (US) 1998-10-06 US disclosed