SCHEMBL11542153

SCHEMBL11542153

CNC(=O)N(S)c1ccccc1C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
KMT2A Q03164 1/20 0.38
GABRA1 P14867 2/20 0.37
GABRB2 P47870 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.35
NLRP3 Q96P20 1/20 0.35
FAAH O00519 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
PTGS1 P23219 1/20 0.34
SLC6A2 P23975 1/20 0.34
HTR2C P28335 1/20 0.34
GABRB3 P28472 1/20 0.34

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
SCHEMBL6616831 0.79 ALOX5 (0.40) LMNAKMT2AGABRA1GABRB2FAAH
SCHEMBL11541431 0.77 TP53 (0.39) LMNAKMT2ASMN1; SMN2CYP3A4HPGD
SCHEMBL24704695 0.76 KMT2A (0.36) LMNAKMT2AGABRA1GABRB2SMN1; SMN2
SCHEMBL11542282 0.76 ALDH1A1 (0.38) KMT2ASMN1; SMN2POLBHPGDSLC6A2
SCHEMBL11514484 0.75 LMNA (0.35) LMNAKMT2AGABRA1GABRB2POLB
SCHEMBL11543045 0.73 PLK1 (0.49) HPGDPTGS1SLC6A2L3MBTL1MAPT
SCHEMBL26524850 0.73 LMNA (0.33) LMNAKMT2AGABRA1GABRB2SMN1; SMN2
SCHEMBL11548288 0.71 ALDH1A1 (0.39) LMNAKMT2ASMN1; SMN2CYP1A2CYP3A4
SCHEMBL11372476 0.71 LMNA (0.42) LMNAKMT2ASMN1; SMN2POLBCYP3A4
SCHEMBL11541466 0.70 TSHR (0.38) LMNAKMT2ASMN1; SMN2CYP1A2CYP3A4

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