SCHEMBL13490646

SCHEMBL13490646

Cc1cccc(C2=CCCN(Cc3ccccc3)C2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
HTR1A P08908 2/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
NCF1 P14598 1/20 0.39
MC4R P32245 1/20 0.39
CCR1 P32246 1/20 0.39
CCR8 P51685 1/20 0.39
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
DRD2 P14416 2/20 0.37

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
SCHEMBL13490484 0.85 KMT2A (0.39) LMNAPOLBSIGMAR1MC4RKMT2A
SCHEMBL13592727 0.84 SIGMAR1 (0.40) LMNASIGMAR1MC4RKMT2AKDM4E
SCHEMBL13490488 0.83 LMNA (0.38) LMNAPOLBSIGMAR1MC4RKMT2A
SCHEMBL13490470 0.80 DRD2 (0.42) LMNAPOLBSIGMAR1KDM4EALDH1A1
SCHEMBL13490649 0.79 DRD4 (0.56) HTR1AALDH1A1TSHRHTTDRD2
SCHEMBL13490577 0.78 LMNA (0.47) LMNAPOLBSIGMAR1MC4RCCR1
SCHEMBL14544020 0.77 ALDH1A1 (0.40) LMNAKMT2AKDM4EALDH1A1GAA
SCHEMBL13490479 0.76 MAPT (0.44) LMNASIGMAR1KMT2AALDH1A1MAPT
SCHEMBL6695609 0.76 GABRA1 (0.38) LMNAPOLBSIGMAR1HTR1AKMT2A
SCHEMBL10640414 0.75 SIGMAR1 (0.52) LMNAPOLBSIGMAR1MC4RDRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029947-A1 Pyridyltetrahydropyridines and Pyridylpiperidines, and Method of Manufacturing Them FUJIFILM FINECHEMICALS CO., LTD 2010-02-04 US disclosed
US-7632950-B2 Pyridyltetrahydropyridines and pyridylpiperidines and method of manufacturing them FUJIFILM FINECHEMICALS CO., LTD (JP) 2009-12-15 US 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-20100029947-A1 Pyridyltetrahydropyridines and Pyridylpiperidines, and Method of Manufacturing Them QDPR, HRH4, HRH2 LMNA 4447/4885POLB 2798/4885SIGMAR1 1466/4885

“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.