SCHEMBL13490355

SCHEMBL13490355

CCN1CC=C(c2ccc(C)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 2/20 0.48
CCR1 P32246 1/20 0.44
CCR5 P51681 1/20 0.44
CCR8 P51685 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
ALOX15 P16050 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
HTR6 P50406 2/20 0.41
DRD4 P21917 5/20 0.40
DRD2 P14416 3/20 0.40
SIGMAR1 Q99720 2/20 0.39
ALDH1A1 P00352 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTR1F P30939 1/20 0.37
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36
HTR1A P08908 2/20 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
SCHEMBL105201 0.82 DRD4 (0.53) ALOX15LMNAHTR6DRD4DRD2
SCHEMBL13490339 0.80 WNT3A (0.48) WNT3AALOX15KDM4EALDH1A1
SCHEMBL13490629 0.80 CCR1 (0.48) WNT3ACCR1CCR5CCR8HDAC6
SCHEMBL171120 0.79 WNT3A (0.45) WNT3AALOX15KDM4ELMNAHTR6
SCHEMBL25124555 0.79 SIGMAR1 (0.60) WNT3AALOX15KDM4ELMNAHTR6
SCHEMBL14544048 0.78 WNT3A (0.60) WNT3AHTR1F
SCHEMBL13490673 0.78 CCR1 (0.43) CCR1CCR5CCR8HDAC6SIGMAR1
SCHEMBL14144244 0.77 SIGMAR1 (0.54) ALOX15KDM4ELMNAHTR6DRD4
SCHEMBL13490346 0.76 WNT3A (0.39) WNT3AALOX15KDM4ELMNAHTR6
SCHEMBL28878894 0.76 CCR1 (0.44) WNT3ACCR1CCR5CCR8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8530662-B2 Pyridyltetrahydropyridines and pyridylpiperidines, and method of manufacturing them FUJIFILM FINECHEMICALS CO., LTD (JP) 2013-09-10 US disclosed
US-20100029947-A1 Pyridyltetrahydropyridines and Pyridylpiperidines, and Method of Manufacturing Them FUJIFILM FINECHEMICALS CO., LTD 2010-02-04 US disclosed
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 WNT3A 4254/4885CCR1 1133/4885CCR5 221/4885

“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.