SCHEMBL20462136

SCHEMBL20462136

CSN(CC(O)Cn1c2ccccc2c2ccccc21)C1(C)CC1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PER2 O15055 13/20 0.63
CRY1 Q16526 13/20 0.63
CRY2 Q49AN0 13/20 0.63
DNM1 Q05193 3/20 0.58
TSHR P16473 4/20 0.56
NPY1R P25929 1/20 0.56
NPY2R P49146 1/20 0.56
BACE1 P56817 1/20 0.53
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL20462245 0.95 PER2 (0.65) PER2CRY1CRY2DNM1TSHR
SCHEMBL20462249 0.95 PER2 (0.65) PER2CRY1CRY2DNM1TSHR
SCHEMBL20462199 0.89 PER2 (0.65) PER2CRY1CRY2DNM1TSHR
SCHEMBL20462299 0.79 PER2 (0.67) PER2CRY1CRY2
SCHEMBL20462257 0.79 PER2 (0.67) PER2CRY1CRY2
SCHEMBL20462138 0.78 PER2 (0.65) PER2CRY1CRY2DNM1TSHR
SCHEMBL15380004 0.78 PER2 (1.00) PER2CRY1CRY2TSHRALDH1A1
SCHEMBL20462195 0.77 PER2 (0.67) PER2CRY1CRY2DNM1TSHR
SCHEMBL20462255 0.74 PER2 (0.67) PER2CRY1CRY2DNM1TSHR
SCHEMBL15380593 0.73 PER2 (1.00) PER2CRY1CRY2TSHRALDH1A1

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
EP-2855458-B1 CARBAZOLE-CONTAINING SULFONAMIDES AS CRYPTOCHROME MODULATORS RESET THERAPEUTICS INC (US) 2018-08-08 EP disclosed