SCHEMBL9734836

SCHEMBL9734836

O=C(O)c1cc2cc3c(cc2o1)CCO3

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 9/20 0.44
CSNK2A1 P68400 4/20 0.44
CSNK2A2 P19784 3/20 0.44
CSNK2B P67870 3/20 0.44
CSNK2A3 Q8NEV1 3/20 0.44
PIM2 Q9P1W9 4/20 0.41
PLA2G10 O15496 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
DYRK1A Q13627 1/20 0.38
PRKCI P41743 1/20 0.37
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 2/20 0.36
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 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
SCHEMBL17782570 0.69 FABP4 (0.48) PLA2G10LMNAPRKCIPOLBKDM4E
SCHEMBL9424948 0.69 PIM1 (0.55) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL29010833 0.68 PLA2G10 (0.39) PLA2G10DYRK1APRKCINPC1RAB9A
SCHEMBL4822486 0.68 PIM1 (0.43) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL11746037 0.67 PIM1 (0.53) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL4310530 0.67 PIM1 (0.53) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL984492 0.66 PRKCI (0.48) DYRK1APRKCIRAB9AMAPTHDAC3
SCHEMBL6239973 0.66 PIM1 (0.60) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL25165984 0.66 PKM (0.43) PLA2G10PRKCINPC1HDAC3HDAC4
SCHEMBL843078 0.66 PLA2G10 (0.48) PLA2G10DYRK1APRKCINPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5100902-A Dopamine and Serotonin Antagonists, Antipsychotic Agents ADIR ET COMPAGNIE (FR) 1992-03-31 US disclosed