SCHEMBL9324917

SCHEMBL9324917

Cc1c(C(C)(C)c2ccccc2)cc(C(C)(C)c2ccccc2)c(O)c1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA3 O75311 1/20 0.50
GLRB P48167 1/20 0.50
ESR1 P03372 3/20 0.41
ESR2 Q92731 3/20 0.41
CYP3A4 P08684 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LDHA P00338 6/20 0.40
LDHB P07195 5/20 0.40
CNR1 P21554 3/20 0.36
CNR2 P34972 3/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
RXRA P19793 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34

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
Water SCHEMBL9345929 0.98 GLRA3 (0.49) GLRA3GLRBESR1ESR2CYP3A4
SCHEMBL9341203 0.98 GLRA3 (0.49) GLRA3GLRBESR1ESR2CYP3A4
Water SCHEMBL9341157 0.98 GLRA3 (0.49) GLRA3GLRBESR1ESR2CYP3A4
Water SCHEMBL9343037 0.97 GLRA3 (0.47) GLRA3GLRBESR1ESR2CYP3A4
SCHEMBL9342077 0.94 GLRA3 (0.56) GLRA3GLRBESR1ESR2CYP3A4
SCHEMBL9345896 0.94 GLRA3 (0.60) GLRA3GLRBESR1ESR2CYP3A4
SCHEMBL11757013 0.90 GLRA3 (0.61) GLRA3GLRBESR1ESR2CYP3A4
SCHEMBL9351686 0.89 GLRA3 (0.41) GLRA3GLRBESR1ESR2CYP3A4
SCHEMBL9757911 0.88 GLRA3 (0.40) GLRA3GLRBESR1ESR2CYP3A4
SCHEMBL9343044 0.88 GLRA3 (0.42) GLRA3GLRBESR1ESR2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0425687-B1 CLATHRATE COMPOUND OF RING-SUBSTITUTED SALICYLIC ACID SALT SANKO KAIHATSU KAGAKU KENK (JP) 1994-07-06 EP claimed
EP-0425687-B1 CLATHRATE COMPOUND OF RING-SUBSTITUTED SALICYLIC ACID SALT SANKO KAIHATSU KAGAKU KENK (JP) 1994-07-06 EP disclosed
EP-0461651-B1 Recording medium FUJI PHOTO FILM CO LTD (JP) 1994-02-16 EP disclosed
US-5128309-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1992-07-07 US disclosed
US-5107006-A Photostabilizers developers SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1992-04-21 US disclosed
US-5049685-A Nuclear substituted salicylic acids and their salts SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1991-09-17 US disclosed
EP-0425687-A1 CLATHRATE COMPOUND OF RING-SUBSTITUTED SALICYLIC ACID SALT Sanko Kaihatsu Kagaku Kenkyusho (JP) 1991-05-08 EP disclosed