SCHEMBL26535362

SCHEMBL26535362

C/C=N\C(=C/C)c1nc2ccccc2c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 2/20 0.43
▸ ALDH1A1 P00352 4/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ POLB P06746 1/20 0.34
▸ MPO P05164 1/20 0.34
▸ RAD52 P43351 1/20 0.34
▸ HTR3E A5X5Y0 1/20 0.34
▸ HTR3B O95264 1/20 0.34
▸ HTR3A P46098 1/20 0.34
▸ HTR3D Q70Z44 1/20 0.34
▸ HTR3C Q8WXA8 1/20 0.34
▸ ERN1 O75460 1/20 0.34
▸ HPGD P15428 3/20 0.33
▸ MAOA P21397 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ GLA P06280 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
SCHEMBL26535603 0.86 GPR3 (0.38) GPR3ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL26535381 0.86 GPR3 (0.40) GPR3ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL26533624 0.84 GPR3 (0.39) GPR3ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL26535392 0.75 GPR3 (0.39) GPR3ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL10196877 0.69 KDM4E (0.50) ALDH1A1SMN1; SMN2MAPTKDM4ECYP1A2
SCHEMBL28299251 0.69 ALDH1A1 (0.56) GPR3ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL3067398 0.69 ALDH1A1 (0.68) GPR3ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL18792399 0.68 ATM (0.37) ALDH1A1MAPTKMT2APOLBKDM4E
SCHEMBL28279288 0.66 MAP2K3 (0.53) GPR3ALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL8573192 0.66 SMN1; SMN2 (0.52) GPR3ALDH1A1SMN1; SMN2MAPTKMT2A

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-2023182835-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 솔루스첨단소재 주식회사 2023-09-28 — — WO disclosed
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