SCHEMBL10370972

SCHEMBL10370972

CC(=O)Nc1c(-c2nnn[nH]2)oc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ KDM4E B2RXH2 4/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ HTT P42858 1/20 0.46
▸ POLB P06746 5/20 0.46
▸ MAPK1 P28482 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ CYP2C19 P33261 2/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ HTR2C P28335 1/20 0.43
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MAPT P10636 1/20 0.38

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
SCHEMBL10370969 0.82 ALOX15 (0.39) TSHRALDH1A1KDM4ESMN1; SMN2POLB
SCHEMBL10371019 0.77 TSHR (0.54) TSHRALDH1A1KDM4ESMN1; SMN2HTT
SCHEMBL31652584 0.75 RAB9A (0.42) TSHRALDH1A1KDM4ESMN1; SMN2HTT
SCHEMBL2774243 0.74 TSHR (0.76) TSHRALDH1A1KDM4ESMN1; SMN2HTT
SCHEMBL10372971 0.73 KDM4E (0.41) ALDH1A1KDM4ESMN1; SMN2POLBMAPK1
SCHEMBL8711671 0.71 DDR2 (0.56) TSHRALDH1A1KDM4ESMN1; SMN2HTT
SCHEMBL12892206 0.69 ALDH1A1 (0.57) TSHRALDH1A1KDM4ESMN1; SMN2CYP1A2
SCHEMBL24046932 0.68 MEN1 (0.64) TSHRALDH1A1KDM4ESMN1; SMN2HTT
SCHEMBL13833847 0.68 ADORA1 (0.51) TSHRALDH1A1KDM4ESMN1; SMN2HTT
SCHEMBL7646411 0.68 NQO1 (0.42) ALDH1A1KDM4EPOLBHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0187487-B1 BENZOTHIOPHENES AND BENZOFURANS HAVING ANTIALLERGIC ACTIVITY WARNER-LAMBERT COMPANY (US) 1990-08-29 — — EP claimed
US-4703053-A Benzothiophenes and benzofurans and antiallergic use thereof WARNER-LAMBERT COMPANY (US) 1987-10-27 — — US claimed
EP-0187487-A1 Benzothiophenes and benzofurans having antiallergic activity WARNER-LAMBERT COMPANY (US) 1986-07-16 — — EP claimed
EP-0187487-B1 BENZOTHIOPHENES AND BENZOFURANS HAVING ANTIALLERGIC ACTIVITY WARNER-LAMBERT COMPANY (US) 1990-08-29 — — EP disclosed
US-4703053-A Benzothiophenes and benzofurans and antiallergic use thereof WARNER-LAMBERT COMPANY (US) 1987-10-27 — — US disclosed
EP-0187487-A1 Benzothiophenes and benzofurans having antiallergic activity WARNER-LAMBERT COMPANY (US) 1986-07-16 — — EP disclosed
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