SCHEMBL2478173

SCHEMBL2478173

C[C@@H](NC(=O)N1CCCCC1c1cc(F)c(O)cc1O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 2/20 0.46
FKBP1A P62942 2/20 0.44
NPC1 O15118 1/20 0.44
EPHX1 P07099 2/20 0.41
LMNA P02545 1/20 0.41
RECQL P46063 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CCR5 P51681 1/20 0.40
KCNQ3 O43525 1/20 0.39
KCNQ2 O43526 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
ADAM17 P78536 1/20 0.39
PRCP P42785 1/20 0.39

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
SCHEMBL16564554 0.83 BCHE (0.42) NPC1EPHX1LMNARECQLALDH1A1
SCHEMBL2474478 0.80 ROCK2 (0.54) RECQLPRCP
SCHEMBL13504441 0.77 RIPK1 (0.38)
SCHEMBL16564280 0.73 ACHE (0.44) NPC1LMNARECQLALDH1A1PRCP
SCHEMBL28257267 0.71 HSD11B1 (0.61) LMNAALDH1A1ADAM17
SCHEMBL25197904 0.70 FKBP1A (0.59) AADATFKBP1ANPC1EPHX1LMNA
SCHEMBL25202155 0.70 FKBP1A (0.59) AADATFKBP1ANPC1EPHX1LMNA
SCHEMBL25218421 0.70 FKBP1A (0.59) AADATFKBP1ANPC1EPHX1LMNA
SCHEMBL25265364 0.70 FKBP1A (0.59) AADATFKBP1ANPC1EPHX1LMNA
SCHEMBL25197324 0.70 FKBP1A (0.59) AADATFKBP1ANPC1EPHX1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373620-A1 NOVEL 4-(AZACYCLOALKYL)BENZENE-1,3-DIOL COMPOUNDS AS TYROSINASE INHIBITORS, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2011-10-12 EP claimed
WO-2010063774-A1 NOVEL 4-(AZACYCLOALKYL)BENZENE-1,3-DIOL COMPOUNDS AS TYROSINASE INHIBITORS, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-06-10 WO claimed
EP-2373620-A1 NOVEL 4-(AZACYCLOALKYL)BENZENE-1,3-DIOL COMPOUNDS AS TYROSINASE INHIBITORS, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2011-10-12 EP disclosed
WO-2010063774-A1 NOVEL 4-(AZACYCLOALKYL)BENZENE-1,3-DIOL COMPOUNDS AS TYROSINASE INHIBITORS, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-06-10 WO disclosed