SCHEMBL18787192

SCHEMBL18787192

CC1CCCC(C(=O)NC[C@@H](N)c2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.46
USP2 O75604 2/20 0.45
HPGD P15428 2/20 0.45
ALDH1A1 P00352 1/20 0.45
TAAR1 Q96RJ0 1/20 0.43
AAK1 Q2M2I8 1/20 0.43
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.42
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
ALOX15 P16050 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.39
ATM Q13315 1/20 0.39
GFER P55789 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL18786305 0.84 AAK1 (0.41) RECQLUSP2HPGDALDH1A1AAK1
SCHEMBL2794663 0.79 ROCK2 (0.53) KDM4EPOLBLMNAALOX15KMT2A
SCHEMBL18769864 0.77 TRPM8 (0.48) HPGDALDH1A1TAAR1LMNAKMT2A
SCHEMBL18547997 0.77 TRPM8 (0.48) HPGDALDH1A1TAAR1LMNAKMT2A
SCHEMBL891299 0.77 TRPM8 (0.48) HPGDALDH1A1TAAR1LMNAKMT2A
SCHEMBL24540457 0.77 TRPM8 (0.48) HPGDALDH1A1TAAR1LMNAKMT2A
SCHEMBL18547814 0.77 TRPM8 (0.48) HPGDALDH1A1TAAR1LMNAKMT2A
SCHEMBL19058567 0.77 TRPM8 (0.48) HPGDALDH1A1TAAR1LMNAKMT2A
SCHEMBL10193093 0.77 TRPM8 (0.48) HPGDALDH1A1TAAR1LMNAKMT2A
SCHEMBL18786583 0.75 KMT2A (0.57) RECQLUSP2HPGDALDH1A1TAAR1

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
WO-2017070418-A1 SYNTHESIS OF CYCLOHEXANE CARBOXAMIDE DERIVATIVES USEFUL AS SENSATES IN CONSUMER PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2017-04-27 WO disclosed