SCHEMBL10604233

SCHEMBL10604233

Cc1cc(O)ccc1N=Nc1ccc(N=Nc2ccc(N=Nc3ccc(O)cc3C)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.62
NPC1 O15118 8/20 0.56
MEN1 O00255 7/20 0.56
KMT2A Q03164 7/20 0.56
RAB9A P51151 7/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
HSP90AA1 P07900 2/20 0.56
MAPT P10636 5/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GLB1 P16278 1/20 0.43
CTRB1 P17538 1/20 0.43
CTRC Q99895 1/20 0.43
HPGD P15428 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43

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
SCHEMBL11316220 1.00 EGFR (0.62) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL11316218 1.00 EGFR (0.62) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL10624387 1.00 EGFR (0.62) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL10624379 1.00 EGFR (0.62) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL14690238 0.98 EGFR (0.66) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL16153074 0.98 EGFR (0.66) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL10939134 0.96 EGFR (0.63) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL10939128 0.96 EGFR (0.63) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL10939124 0.96 EGFR (0.63) EGFRNPC1MEN1KMT2ARAB9A
SCHEMBL27889995 0.93 MEN1 (0.59) EGFRNPC1MEN1KMT2ARAB9A

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-0144020-B1 AZODYES AND LIQUID CRYSTALLINE MATERIALS CONTAINING THESE DYES BASF Aktiengesellschaft (DE) 1989-05-10 EP disclosed
US-4724259-A Azo dyes and liquid-crystalline materials containing these dyes BASF AKTIENGESELLSCHAFT (DE) 1988-02-09 US disclosed
EP-0144020-A2 Azodyes and liquid crystalline materials containing these dyes BASF Aktiengesellschaft (DE) 1985-06-12 EP disclosed
US-4308163-A IMPROVING BLACK COLOR OF DICHROIC DYES GENERAL ELECTRIC COMPANY (US) 1981-12-29 US disclosed