SCHEMBL9170433

SCHEMBL9170433

N#Cc1oc2ccccc2c1-c1ccc(CBr)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 6/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ TNKS O95271 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ PDE9A O76083 1/20 0.36
▸ PTGS2 P35354 3/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ CHRM4 P08173 1/20 0.34
▸ CHRM5 P08912 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ CHRM3 P20309 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ TRPA1 O75762 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ HTT P42858 1/20 0.32

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
SCHEMBL9169243 0.85 PTPN1 (0.42) PTPN1ADORA2ATNKSMAPTPDE9A
SCHEMBL11552940 0.82 ADORA2A (0.51) PTPN1ADORA2ATNKSMAPTPDE9A
SCHEMBL7012510 0.80 PDE9A (0.47) PTPN1ADORA2ATNKSMAPTPDE9A
SCHEMBL10761266 0.78 PTPN1 (0.42) PTPN1TNKSMAPTPTGS2PTGS1
SCHEMBL9176674 0.77 TNKS (0.40) PTPN1ADORA2ATNKSMAPTPTGS2
SCHEMBL9176872 0.75 TNKS (0.51) PTPN1ADORA2ATNKSMAPTALDH1A1
SCHEMBL7007300 0.74 PLK1 (0.43) ADORA2ATNKSMAPTALDH1A1TSHR
SCHEMBL10759258 0.74 TNKS (0.40) PTPN1TNKSMAPTPTGS2PTGS1
SCHEMBL30882027 0.74 CA1 (0.59) ADORA2ATNKSMAPTPDE9AALDH1A1
SCHEMBL13888092 0.72 PTPN1 (0.72) PTPN1

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
EP-0640080-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS. SYNTEX INC (US) 1995-03-01 — — EP disclosed
US-5380739-A Angiotensin II antagonists SYNTEX (U.S.A.) INC. (US) 1995-01-10 — — US disclosed
WO-1993023391-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS SYNTEX (U.S.A.) INC. (US) 1993-11-25 — — WO disclosed
US-5215994-A Treating or preventing hypertension or heart failure FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-01 — — US disclosed
US-5210092-A Hypotensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-11 — — US disclosed
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