SCHEMBL438355

SCHEMBL438355

C=CCNC(NCC=C)(NCC=C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.37
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 4/20 0.33
LMNA P02545 2/20 0.33
HPGD P15428 1/20 0.33
PKM P14618 1/20 0.32
FAAH O00519 1/20 0.32
HCAR3 P49019 1/20 0.32
RAB9A P51151 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL6170683 0.78 TSHR (0.35) TSHRSMN1; SMN2MAPTKMT2AMAPK1
Water SCHEMBL10920606 0.77 TSHR (0.34) TSHRSMN1; SMN2MAPTKMT2AMAPK1
SCHEMBL11663791 0.73 MAPK1 (0.36) TSHRSMN1; SMN2MAPTKMT2AMAPK1
SCHEMBL9509556 0.73 TSHR (0.32) TSHRSMN1; SMN2MAPTKMT2AMAPK1
SCHEMBL7600761 0.72 KMT2A (0.33) TSHRSMN1; SMN2MAPTKMT2AMAPK1
Trifluoroacetic Acid SCHEMBL7707569 0.70 SMN1; SMN2 (0.37) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL3970176 0.69 ALOX15 (0.41) TSHRSMN1; SMN2MAPTKMT2A
SCHEMBL7105417 0.69
SCHEMBL8593888 0.69 TSHR (0.35) TSHRSMN1; SMN2MAPTKMT2AMAPK1
SCHEMBL2850386 0.67 TSHR (0.37) TSHRSMN1; SMN2MAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6088100-A None JP disclosed
US-8536295-B2 Method of imparting corrosion resistance to a substrate surface, and coated substrates prepared thereby SRI INTERNATIONAL (US) 2013-09-17 US disclosed
US-20120101206-A1 METHOD OF IMPARTING CORROSION RESISTANCE TO A SUBSTRATE SURFACE, AND COATED SUBSTRATES PREPARED THEREBY BLUM, YIGAL D, DR 2012-04-26 US disclosed
US-8101242-B2 Method of imparting corrosion resistance to a substrate surface, and coated substrates prepared thereby SRI INTERNATIONAL (US) 2012-01-24 US disclosed
EP-2257606-A2 METHOD OF IMPARTING CORROSION RESISTANCE TO A SUBSTRATE SURFACE, AND COATED SUBSTRATES PREPARED THEREBY SRI International (US) 2010-12-08 EP disclosed
WO-2009111049-A2 METHOD OF IMPARTING CORROSION RESISTANCE TO A SUBSTRATE SURFACE, AND COATED SUBSTRATES PREPARED THEREBY SRI INTERNATIONAL (US) 2009-09-11 WO disclosed
US-20090226742-A1 Method of Imparting Corrosion Resistance to a Substrate Surface, and Coated Substrates Prepared Thereby BLUM, YIGAL D, DR 2009-09-10 US disclosed
JP-H0688100-A DETERGENT COMPOSITOIN SHISEIDO CO LTD 1994-03-29 JP disclosed
JP-H00688100-A 0001-01-01 JP disclosed