SCHEMBL10706002

SCHEMBL10706002

OCCc1c(-c2ccccc2)nc(Cl)n2ncnc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ EGLN1 Q9GZT9 3/20 0.36
▸ PIK3CD O00329 1/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ KDM4E B2RXH2 4/20 0.34
▸ PKM P14618 1/20 0.34
▸ EGLN2 Q96KS0 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ P2RX7 Q99572 1/20 0.34
▸ CYP1A2 P05177 3/20 0.33
▸ USP2 O75604 3/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ CYP2C19 P33261 2/20 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
SCHEMBL9378832 0.84 ALDH1A1 (0.36) ALDH1A1HSD17B10HPGDEGLN1SMN1; SMN2
SCHEMBL10708265 0.81 KDM4E (0.38) ALDH1A1HSD17B10HPGDSMN1; SMN2KDM4E
SCHEMBL11062890 0.81 EGLN1 (0.36) ALDH1A1HSD17B10HPGDEGLN1SMN1; SMN2
SCHEMBL11073593 0.76 ALDH1A1 (0.42) ALDH1A1HPGDSMN1; SMN2KDM4EEGLN2
SCHEMBL9381563 0.70 ADORA2A (0.35) ALDH1A1SMN1; SMN2KDM4EEGLN2MAPK1
SCHEMBL15272037 0.69 PIK3CD (0.46) ALDH1A1HSD17B10HPGDPIK3CDSMN1; SMN2
SCHEMBL7436879 0.67 PDE10A (0.52) ALDH1A1HSD17B10HPGDSMN1; SMN2KDM4E
SCHEMBL11070935 0.66 ADORA2A (0.35) ALDH1A1KDM4ETDP1USP2MAPK1
SCHEMBL9378347 0.65 SRC (0.36) ALDH1A1EGLN1SMN1; SMN2KDM4E
SCHEMBL11064822 0.65 MAPT (0.41) ALDH1A1HSD17B10HPGDSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0152841-B1 6-Substituted-5-phenyltetrazolo[1,5-a][1,2,4]triazolo[1,5-c]pyrimidines G.D. Searle & Co. (US) 1988-07-27 — — EP disclosed
US-4562192-A VASODILATORS, DIURETICS, AND HYPOOTENSIVE AGENTS G. D. SEARLE & CO. (US) 1985-12-31 — — US disclosed
EP-0152841-A1 6-Substituted-5-phenyltetrazolo[1,5-a][1,2,4]triazolo[1,5-c]pyrimidines G.D. Searle & Co. (US) 1985-08-28 — — EP disclosed
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