SCHEMBL9404581

SCHEMBL9404581

Oc1ccccc1C1=C2C=CC(=N2)C(c2ccccc2)=C2C=CC(=N2)C(c2ccccc2)=C2C=CC(=N2)C(c2ccccc2)=C2C=CC1=N2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ BCL2L1 Q07817 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CASP3 P42574 2/20 0.38
▸ SENP8 Q96LD8 2/20 0.38
▸ SENP7 Q9BQF6 2/20 0.38
▸ SENP6 Q9GZR1 2/20 0.38
▸ ALOX15 P16050 2/20 0.38
▸ ADORA2A P29274 2/20 0.38
▸ CHUK O15111 1/20 0.38
▸ TXNRD1 Q16881 1/20 0.38
▸ NOX4 Q9NPH5 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ADORA2B P29275 1/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.37
▸ CYP1A2 P05177 3/20 0.37

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
SCHEMBL498541 0.91 ALDH1A1 (0.40) HPGDALDH1A1BCL2L1HSD17B10L3MBTL1
SCHEMBL28564877 0.85 ALDH1A1 (0.35) HPGDALDH1A1BCL2L1HSD17B10L3MBTL1
SCHEMBL5015297 0.83 KDM4E (0.38) HPGDALDH1A1BCL2L1HSD17B10L3MBTL1
SCHEMBL5013871 0.83 KDM4E (0.38) HPGDALDH1A1BCL2L1HSD17B10L3MBTL1
SCHEMBL27979361 0.82 ALDH1A1 (0.35) HPGDALDH1A1ALOX15SMN1; SMN2MEN1
SCHEMBL28180007 0.82 ALDH1A1 (0.35) HPGDALDH1A1ALOX15SMN1; SMN2MEN1
SCHEMBL7996476 0.82 ALDH1A1 (0.35) HPGDALDH1A1ALOX15SMN1; SMN2MEN1
SCHEMBL14562749 0.82 ALDH1A1 (0.35) HPGDALDH1A1ALOX15SMN1; SMN2MEN1
SCHEMBL2517442 0.82 ALDH1A1 (0.35) HPGDALDH1A1ALOX15SMN1; SMN2MEN1
SCHEMBL28807262 0.82 ALDH1A1 (0.35) HPGDALDH1A1ALOX15SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6279514-A — — None — — JP disclosed
JP-H06279514-A PRODUCTION OF PORPHYRIN IMMOBILIZED ON INORGANIC OXIDE TOKUYAMA SODA CO LTD 1994-10-04 — — JP disclosed
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