SCHEMBL11237883

SCHEMBL11237883

C=CCON=C(Cn1cncn1)c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.53
MAPT P10636 1/20 0.53
LMNA P02545 2/20 0.42
PKM P14618 1/20 0.42
POLB P06746 2/20 0.39
CYP19A1 P11511 4/20 0.39
KDM4E B2RXH2 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL11386202 1.00 HTT (0.53) HTTMAPTLMNAPKMPOLB
SCHEMBL11223080 0.94 HTT (0.48) HTTMAPTLMNAPKMPOLB
SCHEMBL11240865 0.88 MAPT (0.40) HTTMAPTLMNAPKMCYP19A1
SCHEMBL11388927 0.88 MAPT (0.40) HTTMAPTLMNAPKMCYP19A1
SCHEMBL11225151 0.87 MAPT (0.42) HTTMAPTLMNAPKMPOLB
SCHEMBL11381248 0.84 CYP19A1 (0.44) HTTMAPTLMNACYP19A1KDM4E
SCHEMBL11232119 0.84 LMNA (0.56) HTTMAPTLMNAPKMPOLB
SCHEMBL11385996 0.84 LMNA (0.56) HTTMAPTLMNAPKMPOLB
SCHEMBL11229979 0.84 CYP19A1 (0.44) HTTMAPTLMNACYP19A1KDM4E
SCHEMBL11231619 0.83 SMN1; SMN2 (0.39) HTTMAPTCYP19A1KDM4EALDH1A1

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-4357338-A Combating fungi with 1-phenyl-1-oximino-2-(1,2,4-triazol-1-yl)-ethanes BAYER AKTIENGESELLSCHAFT (DE) 1982-11-02 US disclosed
US-4309434-A Combating fungi with 1-(2-chlorophenyl)-1-(2-chlorobenzyloximino)-2-(1,2,4-triazol-1-yl)-ethane BAYER AKTIENGESELLSCHAFT (DE) 1982-01-05 US disclosed
EP-0004917-B1 OXIMINO-TRIAZOLYL ETHANES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1981-05-13 EP disclosed
US-4264772-A Combating fungi with 1-phenyl-1-oximino-2-(1,2,4-triazol-1-yl)-ethanes BAYER AKTIENGESELLSCHAFT (DE) 1981-04-28 US disclosed
EP-0004917-A1 Oximino-triazolyl ethanes, process for their preparation and their use as fungicides BAYER AG (DE) 1979-10-31 EP disclosed