SCHEMBL21732401

SCHEMBL21732401

OC(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccccc1Br

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ CYP19A1 P11511 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ TTR P02766 1/20 0.34
▸ CYP2D6 P10635 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ THRA P10827 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ CYP3A4 P08684 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ CYP3A5 P20815 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31

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
SCHEMBL23696936 0.82 ATM (0.37) CRHBPCRHR2L3MBTL1CYP2D6CYP1A2
SCHEMBL17703255 0.80 SLC6A4 (0.42) CRHBPCRHR2CYP19A1L3MBTL1MEN1
SCHEMBL8784880 0.79 CRHBP (0.46) CRHBPCRHR2CYP19A1CYP2D6CYP1A2
SCHEMBL23279919 0.79 LMNA (0.39) CRHBPCRHR2CYP19A1HPGDMEN1
SCHEMBL21732443 0.76 CYP1A2 (0.41) CRHBPCRHR2CYP19A1CYP2D6CYP1A2
SCHEMBL20101784 0.76 CRHBP (0.36) CRHBPCRHR2CYP19A1CYP2D6CYP1A2
SCHEMBL21858138 0.74 L3MBTL1 (0.47) L3MBTL1THRATHRBCYP3A4LMNA
SCHEMBL6568167 0.74 CYP19A1 (0.51) CRHBPCRHR2CYP19A1MEN1KMT2A
SCHEMBL16177728 0.74 TDP1 (0.40) CYP2D6CYP1A2CYP2C19HSD17B10HTR7
SCHEMBL727333 0.74 ALDH1A1 (0.48) L3MBTL1TTRNPC1RAB9AHTR7

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
WO-2020036314-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DIODE USING SAME 주식회사 엘지화학 2020-02-20 — — WO disclosed
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