SCHEMBL8733581

SCHEMBL8733581

CC(C)(C)OC(=O)NCC1Cc2ccc(O)cc2C1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACACB O00763 8/20 0.47
ACACA Q13085 4/20 0.46
DRD2 P14416 2/20 0.46
NQO2 P16083 1/20 0.44
ESR2 Q92731 1/20 0.43
NAMPT P43490 2/20 0.43
CYP19A1 P11511 1/20 0.42
CYP11B2 P19099 1/20 0.42
APOB P04114 1/20 0.41
MTTP P55157 1/20 0.41
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40

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
SCHEMBL9361441 0.90 DRD2 (0.50) ACACBACACADRD2ESR2CYP19A1
SCHEMBL9133081 0.90 DRD2 (0.50) ACACBACACADRD2ESR2CYP19A1
SCHEMBL9362314 0.90 DRD2 (0.50) ACACBACACADRD2ESR2CYP19A1
SCHEMBL9134300 0.90 DRD2 (0.47) ACACBACACADRD2NQO2ESR2
SCHEMBL22534289 0.85 ACACB (0.47) ACACBACACADRD2NAMPT
SCHEMBL8882262 0.84 ACACB (0.48) ACACBACACADRD2NAMPTCKS1B
SCHEMBL7283668 0.82 ACACB (0.49) ACACBACACADRD2NAMPTCKS1B
SCHEMBL8879555 0.82 TBXA2R (0.46) ACACBACACADRD2NAMPT
SCHEMBL8757882 0.80 ACACB (0.47) ACACBACACADRD2CKS1BSKP1
SCHEMBL8728457 0.80 ACACB (0.50) ACACBACACA

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
US-5750524-A ADMINISTERING AN SULFAMIDE SUBSTITUTED INDAN DERIVATIVE ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
EP-0773019-A1 HYPERLIPEMIA REMEDY ZERIA PHARMACEUTICAL CO., LTD. (JP) 1997-05-14 EP disclosed
EP-0589037-B1 INDIAN DERIVATIVE AND THROMBOXANE ANTAGONIST CONTAINING THE SAME ZERIA PHARM CO LTD (JP) 1996-05-29 EP disclosed
US-5409956-A A sulfonylaminoalkylindan carboxylic acid or ester for treating thrombosis, vasospasm or asthma ZERIA PHARMACEUTICAL CO., LTD. (JP) 1995-04-25 US disclosed
EP-0589037-A1 INDIAN DERIVATIVE AND THROMBOXANE ANTAGONIST CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1994-03-30 EP disclosed