SCHEMBL5156766

SCHEMBL5156766

Cc1cc(F)ccc1C1CN(C(=O)CN2CCCC2)CCC1OCc1ccc(Cl)c(I)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.37
SIGMAR1 Q99720 3/20 0.37
DRD3 P35462 2/20 0.37
TACR1 P25103 7/20 0.37
TACR3 P29371 4/20 0.36
TMEM97 Q5BJF2 1/20 0.36
CCR5 P51681 1/20 0.35
GRM5 P41594 1/20 0.35
KDM4E B2RXH2 1/20 0.35
DRD2 P14416 1/20 0.34
CCNT1 O60563 1/20 0.34
CDK9 P50750 1/20 0.34

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
SCHEMBL5156763 0.93 TACR3 (0.40) DRD4SIGMAR1DRD3TACR1TACR3
SCHEMBL5158527 0.89 TACR1 (0.39) DRD4SIGMAR1TACR1TMEM97KDM4E
SCHEMBL5158719 0.89 KDM4E (0.41) SIGMAR1TACR1TMEM97KDM4ECCNT1
SCHEMBL5174357 0.88 SIGMAR1 (0.39) SIGMAR1TACR1TMEM97KDM4ECCNT1
SCHEMBL5158340 0.88 MEN1 (0.44) DRD4SIGMAR1DRD3TACR1TMEM97
SCHEMBL5158660 0.88 TACR1 (0.39) DRD4SIGMAR1TACR1TMEM97GRM5
SCHEMBL5161802 0.87 TACR1 (0.40) SIGMAR1TACR1TMEM97KDM4ECCNT1
SCHEMBL5159284 0.86 SIGMAR1 (0.40) SIGMAR1TACR1TMEM97KDM4ECCNT1
SCHEMBL5162311 0.86 KMT2A (0.40) TACR1KDM4ECCNT1CDK9
SCHEMBL5156433 0.86 TACR1 (0.39) SIGMAR1TACR1TMEM97KDM4ECCNT1

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-20050256164-A1 NK1 and NK3 antagonists PFIZER INC 2005-11-17 US claimed
EP-1748984-A1 PIPERIDINE DERIVATIVES AS NK1 AND NK3 ANTAGONISTS Pfizer Products Inc. (US) 2007-02-07 EP disclosed
WO-2005110987-A1 PIPERIDINE DERIVATIVES AS NK1 AND NK3 ANTAGONISTS PFIZER PRODUCTS INC. (US) 2005-11-24 WO disclosed
US-20050256164-A1 NK1 and NK3 antagonists PFIZER INC 2005-11-17 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-20050256164-A1 NK1 and NK3 antagonists TAC3, TACR1, TACR2 DRD4 1196/4885SIGMAR1 779/4885DRD3 411/4885

“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.