SCHEMBL6901119

SCHEMBL6901119

Cc1ccc2c(c1)Cc1cc(C)ccc1C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.48
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
RAB9A P51151 1/20 0.46
CYP1A2 P05177 2/20 0.43
CYP2A6 P11509 2/20 0.43
TDP1 Q9NUW8 4/20 0.39
ACHE P22303 3/20 0.39
CYP3A4 P08684 2/20 0.38
PARP10 Q53GL7 2/20 0.38
TP53 P04637 2/20 0.38
PARP11 Q9NR21 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
TRPA1 O75762 1/20 0.38

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
SCHEMBL6905206 1.00 METAP1 (0.48) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL31196693 1.00 METAP1 (0.48) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL6907672 0.92 ALDH1A1 (0.50) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL6905898 0.89 ALDH1A1 (0.47) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL29232849 0.89 METAP1 (0.50) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL6903501 0.86 KDM4E (0.50) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL17460809 0.86 ALDH1A1 (0.48) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL15308827 0.86 ALDH1A1 (0.48) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL29066845 0.86 METAP1 (0.44) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL4897556 0.86 METAP1 (0.57) METAP1MAPTSMN1; SMN2ALDH1A1KDM4E

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-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed
US-20020032256-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-14 US disclosed