SCHEMBL7923161

SCHEMBL7923161

CCC(O)(c1ccccc1)c1ccccc1C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41
OPRK1 P41145 1/20 0.41
KCNH2 Q12809 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
CHRM3 P20309 5/20 0.41
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
CHRM2 P08172 3/20 0.39
CHRM4 P08173 3/20 0.39
CHRM5 P08912 3/20 0.39
CHRM1 P11229 3/20 0.39
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KIF11 P52732 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL7809644 0.88 SMN1; SMN2 (0.47) SMN1; SMN2HTR2AHTR2CADRA1AOPRK1
SCHEMBL10889760 0.82 MEN1 (0.43) SMN1; SMN2KCNH2SIGMAR1CHRM3MEN1
SCHEMBL246639 0.81 SMN1; SMN2 (0.52) SMN1; SMN2KCNH2SIGMAR1CHRM3MEN1
SCHEMBL10816937 0.81 ALDH1A1 (0.47) SMN1; SMN2HTR2AHTR2CADRA1AOPRK1
SCHEMBL24122647 0.80 PDCD1 (0.40) SMN1; SMN2CHRM3MEN1KMT2AKDM4E
SCHEMBL7923507 0.80 HRH4 (0.46) SMN1; SMN2CHRM3KIF11
SCHEMBL11764324 0.79 HTR2A (0.64) SMN1; SMN2HTR2AHTR2CADRA1AOPRK1
SCHEMBL11620674 0.79 HTR2A (0.44) SMN1; SMN2HTR2AHTR2CADRA1AOPRK1
SCHEMBL11621137 0.79 KCNN4 (0.46) SMN1; SMN2HTR2AHTR2CADRA1AOPRK1
SCHEMBL11623430 0.79 HTR2A (0.44) SMN1; SMN2HTR2AHTR2CADRA1AOPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4039589-A LIVER MICROSOMAL ENZYMES RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1977-08-02 US claimed
US-6174898-B1 TREATING FILARIAE IN LYMPHATIC SYSTEM BY ADMINISTERING N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND ESTERS IN WHICH A SUBSTITUTED ALKYL CHAIN FORMS PART OF N-SUBSTITUENT AND SALTS NOVO NORDISK A/S (DK) 2001-01-16 US disclosed
EP-0858339-A1 A METHOD OF TREATING FILARIAE NOVO NORDISK A/S (DK) 1998-08-19 EP disclosed
EP-0502031-B1 N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND A PHARMACEUTICAL COMPOSITION NOVO NORDISK AS (DK) 1997-08-20 EP disclosed
WO-1997017073-A1 A METHOD OF TREATING FILARIAE NOVO NORDISK A/S (DK) 1997-05-15 WO disclosed
US-5198451-A Treatment of epilepsy, inhibitors of gamma-aminobutyric acid uptake from synaptic cleft NOVO NORDISK A/S (DK) 1993-03-30 US disclosed
US-4094908-A Alpha-substituted benzhydrol derivatives RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1978-06-13 US disclosed
US-4039589-A LIVER MICROSOMAL ENZYMES RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1977-08-02 US disclosed