SCHEMBL7607075

SCHEMBL7607075

CCCCCC1(c2ccc(C(=O)O)cc2)CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.50
CNR2 P34972 3/20 0.50
RARB P10826 9/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PLA2G4B P0C869 1/20 0.43
HSD11B1 P28845 1/20 0.43
ALDH1A1 P00352 1/20 0.43
RARA P10276 1/20 0.43
MAPT P10636 1/20 0.43
MTOR P42345 1/20 0.43

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
SCHEMBL5684217 0.99 CNR1 (0.52) CNR1CNR2RARBTP53TSHR
SCHEMBL28947368 0.99 CNR1 (0.52) CNR1CNR2RARBTP53TSHR
SCHEMBL5687199 0.99 CNR1 (0.52) CNR1CNR2RARBTP53TSHR
SCHEMBL9153794 0.96 RARB (0.51) CNR1CNR2RARBTP53TSHR
SCHEMBL5684373 0.95 CNR2 (0.45) CNR1CNR2RARBTP53TSHR
Hydrochloric Acid SCHEMBL11524179 0.95 RARB (0.50) CNR1CNR2RARBTP53TSHR
SCHEMBL30711692 0.90 CNR2 (0.51) CNR1CNR2MEN1KMT2AHSD11B1
SCHEMBL5684336 0.89 HSD11B1 (0.46) CNR1CNR2RARBTP53TSHR
SCHEMBL29992772 0.88 CNR2 (0.53) CNR1CNR2MEN1KMT2AHSD11B1
SCHEMBL30711688 0.87 CNR2 (0.47) CNR1CNR2MEN1KMT2AHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0788511-B1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO (JP) 2002-12-11 EP disclosed
US-6265536-B1 MICROBIOCIDE AND FUNGICIDE WHICH IS INHIBITOR OF BETA-1,3-GLUCAN SYNTHASE; TREATMENT OF PNEUMOCYSTIS CARINII INFECTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-07-24 US disclosed
US-6107458-A FUNGICIDE WHICH IS BETA-1,3-GLYCAN SYNTHASE INHIBITOR; FOR PROPHYLAXIS AND TREATMENT OF PNEUMOCYSTIS CARINII INFECTIONS LIKE PNEUMONIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-22 US disclosed
EP-0788511-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-13 EP disclosed
US-4664840-A DIELECTRIC ANISOTROPY Merck, E. (DE) 1987-05-12 US disclosed