SCHEMBL1474218

SCHEMBL1474218

CC(C)(C)c1ccc(C2CC2C(=O)OCc2ccccc2)c(-c2ccncc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.39
DRD1 P21728 1/20 0.39
TBXA2R P21731 1/20 0.39
DRD4 P21917 1/20 0.39
DRD5 P21918 1/20 0.39
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39
DRD3 P35462 1/20 0.39
PTGFR P43088 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
PTGIR P43119 1/20 0.39
CYP11B1 P15538 3/20 0.37
CYP11B2 P19099 3/20 0.37
POLB P06746 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
CYP19A1 P11511 2/20 0.36
KIF11 P52732 1/20 0.36
NAMPT P43490 1/20 0.36
DGAT2 Q96PD7 1/20 0.35

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
SCHEMBL1476574 0.82 KIF11 (0.41) DRD2DRD1TBXA2RDRD4DRD5
SCHEMBL1474361 0.81 ALDH1A1 (0.40) ALDH1A1MRGPRX4
SCHEMBL1474951 0.79 CPB1 (0.39) POLBALDH1A1HPGDMRGPRX4
SCHEMBL28101021 0.68 FABP7 (0.55) ALDH1A1
SCHEMBL1838938 0.68 ALDH1A1 (0.55) POLBALDH1A1
SCHEMBL1838935 0.68 ALDH1A1 (0.55) POLBALDH1A1
SCHEMBL5287446 0.66 MEN1 (0.40) POLBALDH1A1
SCHEMBL1474655 0.66 MAPT (0.45) ALDH1A1NPSR1
SCHEMBL5294802 0.66 MEN1 (0.42) POLBALDH1A1
SCHEMBL22869346 0.65 FABP7 (0.48) POLBALDH1A1HPGD

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 DRD2 143/4885DRD1 149/4885TBXA2R 417/4885
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS CNR1, HVCN1, CNR2 DRD2 149/4885DRD1 164/4885TBXA2R 392/4885

“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.