SCHEMBL8149797

SCHEMBL8149797

CC1=C(C(=O)Oc2ccc(NC(=O)c3ccccc3C=O)cc2)N=c2cc3c(c(C)c21)=Nc1ccccc1-3

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
LMNA P02545 1/20 0.36
GAA P10253 4/20 0.36
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HTT P42858 2/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 3/20 0.34
CRHBP P24387 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
CRHR2 Q13324 1/20 0.33
OPRL1 P41146 1/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 2/20 0.33
TYK2 P29597 1/20 0.33
PNLIP P16233 2/20 0.33

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
SCHEMBL8909578 0.78 HPGD (0.41) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL8910285 0.78 PARP10 (0.44) GAAALDH1A1KMT2AMAPTPOLB
SCHEMBL8909858 0.76 MAPT (0.30) KMT2AMAPT
SCHEMBL8148024 0.74 TDP2 (0.40) NPC1MEN1KMT2AHTTMAPT
SCHEMBL8910407 0.72 BCHE (0.39) KMT2AHTT
SCHEMBL8155023 0.72 HTT (0.33) SMN1; SMN2KMT2AHTTMAPT
SCHEMBL8910147 0.72 LMNA (0.31) LMNAALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL8910392 0.71 CCNB2 (0.32) LMNAHTTMAPT
SCHEMBL8540291 0.70 MYC (0.33) ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL8910714 0.70 ALDH1A1 (0.34) NPC1LMNAALDH1A1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0741729-A1 ANTITUMOUR TETRACYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1996-11-13 EP claimed
WO-1995021170-A1 ANTITUMOUR TETRACYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1995-08-10 WO claimed
US-6013807-A Antitumor tetracyclic compounds UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2000-01-11 US disclosed
US-5852204-A Pyrrolo 3,2-b-!-carbazoles and 1H 1!benzothieno 2,3-f! indoles having anti-tumor activity UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 1998-12-22 US disclosed
EP-0741729-A1 ANTITUMOUR TETRACYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1996-11-13 EP disclosed
WO-1995021170-A1 ANTITUMOUR TETRACYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1995-08-10 WO disclosed