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SCHEMBL20462249

SCHEMBL20462249

CSN(CC(O)Cn1c2ccccc2c2ccccc21)C1(C)CCCC1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PER2 O15055 15/20 0.65
▸ CRY1 Q16526 15/20 0.65
▸ CRY2 Q49AN0 15/20 0.65
▸ DNM1 Q05193 3/20 0.56
▸ TSHR P16473 1/20 0.53
▸ NPY1R P25929 1/20 0.53
▸ NPY2R P49146 1/20 0.53
▸ BACE1 P56817 1/20 0.50
▸ ALDH1A1 P00352 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 0.98 PER2 (0.65) PER2CRY1CRY2DNM1TSHR
SCHEMBL20462136 0.95 PER2 (0.63) PER2CRY1CRY2DNM1TSHR
SCHEMBL20462199 0.87 PER2 (0.65) PER2CRY1CRY2DNM1TSHR
SCHEMBL20462299 0.84 PER2 (0.67) PER2CRY1CRY2
SCHEMBL20462257 0.81 PER2 (0.67) PER2CRY1CRY2
SCHEMBL15380145 0.79 PER2 (1.00) PER2CRY1CRY2TSHRALDH1A1
SCHEMBL15380593 0.76 PER2 (1.00) PER2CRY1CRY2TSHRALDH1A1
SCHEMBL20462138 0.76 PER2 (0.65) PER2CRY1CRY2DNM1TSHR
SCHEMBL20462195 0.75 PER2 (0.67) PER2CRY1CRY2DNM1TSHR
SCHEMBL15380004 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