SCHEMBL284052

SCHEMBL284052

CCC(=O)c1ccc2cc(C(C)(O)C(F)(F)F)ccc2c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 13/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 1/20 0.42
PTPN1 P18031 3/20 0.41
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
ATM Q13315 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
SCHEMBL284094 0.87 ALDH1A1 (0.43) SMN1; SMN2NPC1ALDH1A1RAB9APTPN1
SCHEMBL1842933 0.83 PTPN1 (0.59) HSD11B1PTPN1KDM4E
SCHEMBL263313 0.83 PTPN1 (0.59) HSD11B1PTPN1KDM4E
SCHEMBL284008 0.83 ALDH1A1 (0.47) SMN1; SMN2NPC1ALDH1A1RAB9APTPN1
SCHEMBL269488 0.82 PTPN1 (0.43) HSD11B1PTPN1
SCHEMBL284015 0.82 ALDH1A1 (0.40) SMN1; SMN2NPC1ALDH1A1RAB9APTPN1
SCHEMBL264109 0.79 CYP17A1 (0.50) HSD11B1ALDH1A1PTPN1KDM4EHPGD
SCHEMBL21573033 0.79 ALDH1A1 (0.59) SMN1; SMN2NPC1ALDH1A1RAB9APTPN1
SCHEMBL3237077 0.74 NPC1 (0.53) SMN1; SMN2NPC1ALDH1A1RAB9APTPN1
SCHEMBL29722835 0.74 PTPN1 (0.53) HSD11B1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8134004-B2 Substituted N-bicyclicalkyl bicycliccarboxyamide compounds PFIZER INC. (US) 2012-03-13 US disclosed
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 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-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS OPRL1, CNR1, TRPV1 HSD11B1 2187/4885SMN1; SMN2 1166/4885NPC1 443/4885

“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.