SCHEMBL5158465

SCHEMBL5158465

COc1ccc(CC(C(=O)NC2CCNCC2c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.42
FPR1 P21462 2/20 0.41
MMP1 P03956 1/20 0.41
PSMB5 P28074 1/20 0.41
KDM1A O60341 2/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
CHRM1 P11229 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL5156707 0.90 KDM1A (0.47) FPR1KDM1AMAPTPKMCHRM1
SCHEMBL5156105 0.87 ALDH1A1 (0.43) TACR1FPR1MAPTPKMALDH1A1
SCHEMBL5159699 0.83 MAPT (0.38) TACR1FPR1KDM1AMAPTPKM
SCHEMBL5161860 0.82 MAPT (0.47) FPR1KDM1AMAPTPKMALDH1A1
SCHEMBL5176925 0.81 KDM1A (0.46) FPR1KDM1AMAPTPKM
SCHEMBL5161629 0.78 KDM1A (0.42) FPR1KDM1AMAPTPKMALDH1A1
SCHEMBL6482545 0.78 KDM1A (0.43) FPR1KDM1AMAPTPKMALDH1A1
SCHEMBL5161850 0.77 KDM1A (0.43) FPR1KDM1AMAPTPKM
SCHEMBL5161368 0.77 GRM7 (0.48) FPR1KDM1AMAPTPKM
SCHEMBL5158998 0.74 SSTR4 (0.53) FPR1KDM1AMAPTPKM

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 TACR1 2/4885FPR1 607/4885MMP1 3572/4885

“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.