SCHEMBL1474342

SCHEMBL1474342

C[C@]1(c2ccc(C(F)(F)F)cc2)C[C@@H]1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.45
MAOB P27338 2/20 0.45
KDM1A O60341 1/20 0.45
FFAR1 O14842 2/20 0.42
OPRM1 P35372 1/20 0.41
OPRL1 P41146 1/20 0.41
BACE1 P56817 1/20 0.39
NOTUM Q6P988 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
CCR2 P41597 2/20 0.39
APP P05067 1/20 0.39
SRD5A2 P31213 1/20 0.39
THRB P10828 1/20 0.38
NR4A1 P22736 1/20 0.38
NR4A2 P43354 1/20 0.38
NR4A3 Q92570 1/20 0.38

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
SCHEMBL10253599 1.00 MAOA (0.45) MAOAMAOBKDM1AFFAR1OPRM1
SCHEMBL10288347 1.00 MAOA (0.45) MAOAMAOBKDM1AFFAR1OPRM1
SCHEMBL10253293 1.00 MAOA (0.45) MAOAMAOBKDM1AFFAR1OPRM1
SCHEMBL1474429 1.00 MAOA (0.45) MAOAMAOBKDM1AFFAR1OPRM1
SCHEMBL1473573 0.86 RORC (0.38) FFAR1
SCHEMBL27720043 0.86 MAOA (0.47) MAOAMAOBKDM1ABACE1CES2
SCHEMBL1474183 0.85 GRIN2B (0.40) SRD5A2
SCHEMBL9820894 0.85 GRIN2B (0.40) SRD5A2
SCHEMBL18685458 0.81 CCR2 (0.48) MAOAMAOBCCR2
SCHEMBL18685298 0.81 CCR2 (0.48) MAOAMAOBCCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1861359-B1 N-(N-SULFONYLAMINOMETHYL)CYCLOPROPANECARBOXAMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF PAIN PFIZER (US) 2012-11-14 EP disclosed
US-7915448-B2 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER INC. (US) 2011-03-29 US disclosed
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS PFIZER INC 2010-02-11 US disclosed
US-7622589-B2 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER INC. (US) 2009-11-24 US disclosed
US-20060211741-A1 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER, INC. 2006-09-21 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 (2 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-20060211741-A1 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists CNR1, HVCN1, CNR2 MAOA 2818/4885MAOB 2691/4885KDM1A 2906/4885
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS CNR1, HVCN1, CNR2 MAOA 2855/4885MAOB 2722/4885KDM1A 3062/4885

“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.