SCHEMBL7730775

SCHEMBL7730775

COc1ccc(N=CC=Cc2ccco2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.52
ALDH1A1 P00352 13/20 0.52
MEN1 O00255 11/20 0.52
KMT2A Q03164 11/20 0.52
POLB P06746 10/20 0.52
L3MBTL1 Q9Y468 5/20 0.52
KDM4E B2RXH2 5/20 0.52
RECQL P46063 3/20 0.52
BLM P54132 2/20 0.52
MAPK1 P28482 1/20 0.52
MCL1 Q07820 1/20 0.52
GAA P10253 5/20 0.50
HTT P42858 4/20 0.50
USP2 O75604 2/20 0.50
RAB9A P51151 3/20 0.47
LMNA P02545 3/20 0.46
HPGD P15428 2/20 0.45
GLA P06280 1/20 0.45
PKM P14618 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44

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
N-Furfurylidene-P-Anisidine SCHEMBL7735571 0.81 ALDH1A1 (0.62) MAPTALDH1A1MEN1KMT2APOLB
N-Furfurylidene-P-Anisidine SCHEMBL11377145 0.81 ALDH1A1 (0.62) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL30380017 0.81 MAPT (0.51) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL3031551 0.77 POLB (0.51) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL3031548 0.77 POLB (0.51) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL3031546 0.77 POLB (0.51) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL8952516 0.75 MAPT (0.55) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL22340707 0.75 TRPA1 (0.59) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL10662429 0.75 TRPA1 (0.59) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL7731715 0.75 TRPA1 (0.59) MAPTALDH1A1MEN1KMT2AL3MBTL1

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-0690856-B1 ANTI-TUMOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, METHODS FOR PREPARATION THEREOF AND FOR TREATMENT UNIV NEW YORK STATE RES FOUND (US) 2002-12-04 EP disclosed
US-5705508-A FORMING TAXOL DERIVATIVES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1998-01-06 US disclosed
US-5599820-A Anti-tumor compounds, pharmaceutical compositions, methods for preparation thereof and for treatment THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1997-02-04 US disclosed
US-5475011-A Anti-tumor compounds, pharmaceutical compositions, methods for preparation thereof and for treatment THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1995-12-12 US disclosed