SCHEMBL29625614

SCHEMBL29625614

Cc1cc(-n2c3cc4ccccc4cc3c3c4ccccc4ccc32)c(Br)c(-n2c3cc4ccccc4cc3c3c4ccccc4ccc32)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CYP1A2 P05177 4/20 0.33
▸ CYP2A6 P11509 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ CYP1B1 Q16678 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ TERT O14746 1/20 0.32
▸ TYMS P04818 1/20 0.31
▸ LCK P06239 1/20 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
SCHEMBL29625558 0.96 HIF1A (0.32) HIF1AHSD17B10TSHRCYP3A4HPGD
SCHEMBL29625631 0.90 KIF11 (0.33) POLB
SCHEMBL29625577 0.87 TDP1 (0.39) HIF1AHSD17B10TSHRHPGDMAPK1
SCHEMBL29625627 0.86 IDO1 (0.32) HIF1AHSD17B10ALDH1A1CYP1B1
SCHEMBL29625597 0.86 UGT2B7 (0.32) HIF1AHSD17B10ALDH1A1CYP1B1
SCHEMBL29625603 0.85 HTR6 (0.37) HIF1AHSD17B10HPGDCYP1A2ALDH1A1
SCHEMBL29625584 0.84 TDP1 (0.36) HIF1AHSD17B10TSHRHPGDCYP1A2
SCHEMBL29625628 0.84 TDP1 (0.36) HIF1AHSD17B10TSHRHPGDATM
SCHEMBL29625626 0.83 TDP1 (0.35) HIF1AHSD17B10TSHRHPGDATM
SCHEMBL29625586 0.82 TDP1 (0.38) HIF1AHSD17B10TSHRCYP1A2ALDH1A1

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-2022131780-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 솔루스첨단소재 주식회사 2022-06-23 — — WO disclosed
Send feedback