SCHEMBL10568031

SCHEMBL10568031

O=C1CCc2c(O)cccc2N1Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.61
▸ EGLN1 Q9GZT9 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ GAA P10253 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ HTR6 P50406 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ F2 P00734 1/20 0.43
▸ PLG P00747 1/20 0.43
▸ ELANE P08246 1/20 0.43
▸ CTSG P08311 1/20 0.43
▸ CMA1 P23946 1/20 0.43
▸ CTRC Q99895 1/20 0.43
▸ CHRM2 P08172 1/20 0.43

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
SCHEMBL15610987 0.82 EGLN1 (0.57) POLBEGLN1L3MBTL1GAAALDH1A1
SCHEMBL11250926 0.80 ATAD2 (0.44) POLBALDH1A1CYP1A2SMN1; SMN2CHRM1
SCHEMBL14253731 0.77 HTR6 (0.63) POLBL3MBTL1GAACYP1A2CYP2C9
SCHEMBL290791 0.77 POLB (0.70) POLBL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL18362074 0.77 SCN9A (0.44) POLBEGLN1L3MBTL1CHRM1
SCHEMBL11063088 0.77 HTR1A (0.40) L3MBTL1GAADRD2
SCHEMBL10688767 0.76 POLB (1.00) POLBL3MBTL1GAAALDH1A1CYP1A2
SCHEMBL29880432 0.76 POLB (1.00) POLBL3MBTL1GAAALDH1A1CYP1A2
SCHEMBL7289981 0.76 OPRM1 (0.60) DRD2CHRM3DRD4DRD3
Bicarbonate SCHEMBL25171118 0.76 POLB (0.64) POLBL3MBTL1GAAALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4824840-A ANTIHISTAMINES, NERVOUS SYSTEM CONTROLLERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-04-25 — — US disclosed
US-4734416-A ANTIHISTAMINES, CENTRAL NERVOUS SYSTEM CONTROLLING ACTION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-03-29 — — US disclosed
US-4329468-A ADRENERGIC BLOCKING AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1982-05-11 — — US disclosed
US-4256890-A ADRENERGIC BLOCKING AGENTS OTSUKAPHARMACEUTICAL CO., LTD. (JP) 1981-03-17 — — US disclosed
US-4065456-A CNS DEPRESSANTS OTSUKA PHARMACEUTICAL CO., LTD. (JA) 1977-12-27 — — US disclosed
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