SCHEMBL5158719

SCHEMBL5158719

Cc1cc(F)ccc1C1CN(C(=O)CN2CCCC2)CCC1OCc1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
TACR1 P25103 9/20 0.41
SIGMAR1 Q99720 3/20 0.39
TMEM97 Q5BJF2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CCNT1 O60563 1/20 0.38
CDK9 P50750 1/20 0.38
CYP2D6 P10635 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
USP14 P54578 1/20 0.37
USP7 Q93009 1/20 0.37
HRH1 P35367 1/20 0.37
PREP P48147 1/20 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
SCHEMBL5158527 0.95 TACR1 (0.39) KDM4ETACR1SIGMAR1TMEM97ALDH1A1
SCHEMBL5156433 0.95 TACR1 (0.39) KDM4ETACR1SIGMAR1TMEM97ALDH1A1
SCHEMBL6482708 0.95 SIGMAR1 (0.41) KDM4ETACR1SIGMAR1TMEM97ALDH1A1
SCHEMBL5161802 0.94 TACR1 (0.40) KDM4ETACR1SIGMAR1TMEM97ALDH1A1
SCHEMBL5158817 0.93 TACR1 (0.46) TACR1CYP2D6CYP3A4CYP2C9
SCHEMBL5161363 0.92 KCNH2 (0.40) TACR1
SCHEMBL5156763 0.91 TACR3 (0.40) TACR1SIGMAR1CYP2D6CYP3A4CYP2C9
SCHEMBL5158660 0.91 TACR1 (0.39) KDM4ETACR1SIGMAR1TMEM97CCNT1
SCHEMBL5158825 0.91 TACR1 (0.39) KDM4ETACR1SIGMAR1TMEM97ALDH1A1
SCHEMBL5159284 0.91 SIGMAR1 (0.40) KDM4ETACR1SIGMAR1TMEM97CCNT1

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 KDM4E 2227/4885TACR1 2/4885SIGMAR1 779/4885

“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.