SCHEMBL11546205

SCHEMBL11546205

CNC(=O)N(S)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
MMP13 P45452 1/20 0.42
ALDH1A1 P00352 6/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TSHR P16473 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
LMNA P02545 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HTT P42858 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
SCHEMBL11150730 0.84 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2TSHRPOLBGAA
SCHEMBL11543446 0.84 ALDH1A1 (0.47) RAB9AALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL11550075 0.82 TDP1 (0.40) RAB9AALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL11372476 0.82 LMNA (0.42) RAB9AALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL11373630 0.81 TDP1 (0.52) RAB9AALDH1A1SMN1; SMN2POLBTDP1
SCHEMBL4053439 0.81 MAPT (0.44) RAB9ASMN1; SMN2TSHRPOLBGAA
SCHEMBL11546145 0.79 MAPT (0.41) RAB9AALDH1A1SMN1; SMN2HDAC1HDAC6
SCHEMBL5814273 0.78 ROCK2 (0.53) RAB9AMMP13ALDH1A1SMN1; SMN2TSHR
SCHEMBL11545872 0.77 MAPT (0.47) RAB9AALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL11798977 0.77 RAB9A (0.53) RAB9AMMP13ALDH1A1SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4148799-A Process for the preparation of 2-aryliminothiazoline solutions BAYER AKTIENGESELLSCHAFT (DE) 1979-04-10 US disclosed