SCHEMBL10758022

SCHEMBL10758022

Oc1cc(-c2ccccc2)nc2ccc3nc[nH]c3c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 2/20 0.49
▸ ADORA2A P29274 2/20 0.49
▸ ADORA1 P30542 2/20 0.49
▸ QPCT Q16769 1/20 0.40
▸ QPCTL Q9NXS2 1/20 0.40
▸ IDO1 P14902 2/20 0.39
▸ TDO2 P48775 1/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.37
▸ MAPT P10636 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ NTSR1 P30989 1/20 0.37
▸ LMNA P02545 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ PDE10A Q9Y233 1/20 0.37
▸ TOP1 P11387 1/20 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
SCHEMBL10752944 0.84 ADORA1 (0.50) ADORA3ADORA2AADORA1ESR1ESR2
SCHEMBL11829399 0.76 PDE3B (0.36) QPCTQPCTLKDM4EMAPTKMT2A
SCHEMBL11840840 0.72 MAP4K4 (0.33) QPCTQPCTL
Hydrochloric Acid SCHEMBL10751428 0.71 ABCG2 (0.43) ADORA3ADORA2AADORA1MAPTHPGD
Hydrochloric Acid SCHEMBL10756788 0.71 ADORA3 (0.38) ADORA3ADORA2AADORA1KDM4EMAPT
Hydrochloric Acid SCHEMBL10753803 0.71 ABCG2 (0.60) ADORA3ADORA2AADORA1
Hydrochloric Acid SCHEMBL11844430 0.70 ALDH1A1 (0.47) ADORA3ADORA2AADORA1ESR1ESR2
SCHEMBL10611217 0.70 SMN1; SMN2 (0.46) IDO1TDO2ESR1ESR2KDM4E
SCHEMBL1520970 0.69 QPCT (0.40) QPCTQPCTLKDM4EMAPTALDH1A1
SCHEMBL10756075 0.68 PARP1 (0.35) QPCTQPCTLKDM4EMAPTMAPK10

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
US-4716168-A STIMULANTS OF IMMUNE RESPONSE NORWICH EATON PHARMACEUTICALS, INC. (US) 1987-12-29 — — US disclosed
US-3947434-A 9-(P-phenylazoanilino)-7-methyl-1H-imidazo[4,5-f]quinolines MORTON-NORWICH PRODUCTS, INC. (US) 1976-03-30 — — US disclosed
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