SCHEMBL3484512

SCHEMBL3484512

O=C1Cc2c(O)ccc(F)c2N1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.51
DRD1 P21728 2/20 0.51
DRD4 P21917 2/20 0.51
DRD5 P21918 2/20 0.51
DRD3 P35462 2/20 0.51
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
GSK3B P49841 1/20 0.35
CCNB3 Q8WWL7 1/20 0.35
AHR P35869 2/20 0.33
CMA1 P23946 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP2 O95551 1/20 0.32
TNIK Q9UKE5 1/20 0.32
OPRL1 P41146 1/20 0.32

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
SCHEMBL26640480 0.84 DRD2 (0.41) DRD2DRD1DRD4DRD5DRD3
SCHEMBL9652469 0.84 SRD5A1 (0.40) DRD2DRD1DRD4DRD5DRD3
SCHEMBL3484935 0.79 AHR (0.50) DRD2DRD1DRD4DRD5DRD3
SCHEMBL19210878 0.78 DRD2 (0.37) DRD2DRD1DRD4DRD5DRD3
SCHEMBL22691798 0.78 DRD2 (0.37) DRD2DRD1DRD4DRD5DRD3
SCHEMBL29422962 0.78 DRD2 (0.37) DRD2DRD1DRD4DRD5DRD3
SCHEMBL31393689 0.77 DRD2 (0.38) DRD2DRD1DRD4DRD5DRD3
SCHEMBL28775009 0.77 DRD2 (0.38) DRD2DRD1DRD4DRD5DRD3
SCHEMBL31425711 0.76 DRD2 (0.40) DRD2DRD1DRD4DRD5DRD3
SCHEMBL20612989 0.75 MB (0.34) DRD2DRD1DRD4DRD5DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3421454-B9 PIPERIDINE DERIVATIVE OTSUKA PHARMA CO LTD (JP) 2023-08-09 EP disclosed
EP-3421454-B1 PIPERIDINE DERIVATIVE OTSUKA PHARMA CO LTD (JP) 2023-04-05 EP disclosed
CN-108884044-B Piperidine derivatives 大塚制药株式会社 2023-01-31 CN disclosed
US-10851079-B2 Piperidine derivative OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-12-01 US disclosed
US-20190040039-A1 PIPERIDINE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-02-07 US disclosed
EP-3421454-A1 PIPERIDINE DERIVATIVE Otsuka Pharmaceutical Co., Ltd. (JP) 2019-01-02 EP disclosed
US-20100004238-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 US disclosed
CN-101611041-A Condensed heterocyclic compouds TAKEDA PHARMACEUTICAL (JP) 2009-12-23 CN disclosed
EP-2103620-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-09-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100004238-A1 FUSED HETEROCYCLIC COMPOUND ERBB2, ROS1, FLT3 DRD2 1841/4885DRD1 2144/4885DRD4 2385/4885
US-10851079-B2 Piperidine derivative EP300, SLC11A2, TBC1D5 DRD2 114/4885DRD1 60/4885DRD4 84/4885
US-20190040039-A1 PIPERIDINE DERIVATIVE EP300, SLC11A2, TBC1D5 DRD2 114/4885DRD1 60/4885DRD4 84/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.