SCHEMBL3045304

SCHEMBL3045304

CN1CCC(N(C)C(=O)CSc2ccc(F)cc2Cl)CC1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.45
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 2/20 0.41
KCNH2 Q12809 2/20 0.40
HTR2C P28335 2/20 0.40
CCR5 P51681 2/20 0.40
P2RX7 Q99572 1/20 0.39

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
SCHEMBL3046879 0.83 ALDH1A1 (0.41) ALDH1A1POLBKMT2ACCR5
SCHEMBL3053627 0.82 POLB (0.52) HTR2AALDH1A1POLBKMT2AKCNH2
SCHEMBL3047400 0.78 ALDH1A1 (0.47) HTR2AALDH1A1POLBKMT2AHTR2C
SCHEMBL30522694 0.76 ALDH1A1 (0.47) HTR2AALDH1A1POLBKMT2AHTR2C
SCHEMBL28483843 0.76 ALDH1A1 (0.47) HTR2AALDH1A1POLBKMT2AHTR2C
SCHEMBL3038887 0.72 KMT2A (0.47) ALDH1A1POLBKMT2ACCR5
SCHEMBL3047425 0.70 MAPT (0.62) HTR2APOLBKMT2AKCNH2HTR2C
SCHEMBL7819980 0.70 KDM4E (0.42) ALDH1A1KMT2A
SCHEMBL3050521 0.68 POLB (0.71) ALDH1A1POLBKMT2ACCR5
SCHEMBL4377596 0.68 USP2 (0.51) ALDH1A1KMT2A

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
EP-1434765-B1 SUBSTITUTED PIPERIDINES WITH SELECTIVE BINDING TO HISTAMINE H3-RECEPTOR HIGH POINT PHARMACEUTICALS LLC (US) 2009-12-02 EP claimed
US-20100222386-A1 SUBSTITUTED PIPERIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 US disclosed
US-20100222386-A1 SUBSTITUTED PIPERIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 US disclosed
US-20100222386-A1 SUBSTITUTED PIPERIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 US disclosed
US-7767695-B2 Substituted piperidines HIGH POINT PHARMACEUTICALS, LLC (US) 2010-08-03 US disclosed
US-7767695-B2 Substituted piperidines HIGH POINT PHARMACEUTICALS, LLC (US) 2010-08-03 US disclosed
US-7767695-B2 Substituted piperidines HIGH POINT PHARMACEUTICALS, LLC (US) 2010-08-03 US disclosed
EP-1434765-B1 SUBSTITUTED PIPERIDINES WITH SELECTIVE BINDING TO HISTAMINE H3-RECEPTOR HIGH POINT PHARMACEUTICALS LLC (US) 2009-12-02 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 (1 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-20100222386-A1 SUBSTITUTED PIPERIDINES HRH3, HRH4, HRH2 HTR2A 34/4885ALDH1A1 1285/4885POLB 3476/4885

“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.