SCHEMBL9520874

SCHEMBL9520874

COCOc1ccc(C(c2ccc(OCOC)cc2)c2ccccc2CNC(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.50
▸ MEN1 O00255 6/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ ATM Q13315 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.44
▸ MTOR P42345 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ GRM7 Q14831 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ NR3C1 P04150 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ NR3C2 P08235 1/20 0.34
▸ AR P10275 1/20 0.34
▸ TSHR P16473 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ GAA P10253 1/20 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
SCHEMBL9125185 0.79 MEN1 (0.38) KMT2AMEN1L3MBTL1TDP1ALDH1A1
SCHEMBL9125178 0.79 NPC1 (0.37) KMT2AMEN1RAB9ANR3C1PGR
SCHEMBL9126112 0.76 KDM4E (0.40) KMT2AMEN1L3MBTL1TDP1ALDH1A1
SCHEMBL9123842 0.76 KDM4E (0.40) KMT2AMEN1L3MBTL1TDP1ALDH1A1
Hydrochloric Acid SCHEMBL9523597 0.76 L3MBTL1 (0.50) KMT2AMEN1L3MBTL1ATMPOLB
SCHEMBL10370086 0.75 TRPV6 (0.46) KMT2AMEN1ALDH1A1KDM4E
SCHEMBL9523527 0.75 MEN1 (0.36) KMT2AMEN1
SCHEMBL9123812 0.73 ALDH1A1 (0.36) TDP1RAB9AALDH1A1NR3C1PGR
SCHEMBL9126148 0.72 KMT2A (0.46) KMT2AMEN1ALDH1A1TSHRCYP3A4
SCHEMBL10368597 0.71 FFAR1 (0.39) KMT2AMEN1L3MBTL1ATMNR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0395093-B1 TRIPHENYLMETHANE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-09-01 — — EP disclosed
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