SCHEMBL13313613

SCHEMBL13313613

CC(C)(C(=O)N[C@@H]1CCCC[C@H]1O)c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.45
TRPV1 Q8NER1 1/20 0.42
CNR1 P21554 16/20 0.42
TACR2 P21452 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
AVPR1A P37288 1/20 0.41
CNR2 P34972 4/20 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
SCHEMBL3143316 0.81 EPHX1 (0.55) P2RX7AVPR1A
SCHEMBL25464169 0.79 LMNA (0.50) P2RX7AVPR1A
SCHEMBL31359373 0.78 F10 (0.56) CNR1TACR2TAS1R3TAS1R1TAS1R2
SCHEMBL13313619 0.77 P2RX7 (0.40) P2RX7AVPR1A
SCHEMBL3135707 0.77 P2RX7 (0.40) P2RX7AVPR1A
SCHEMBL3135713 0.77 P2RX7 (0.40) P2RX7AVPR1A
SCHEMBL3135716 0.77 P2RX7 (0.40) P2RX7AVPR1A
SCHEMBL13348709 0.75 P2RX7 (0.39) P2RX7AVPR1A
SCHEMBL3144414 0.75 PTGES (0.46) P2RX7CNR1
SCHEMBL22169758 0.73 CCR2 (0.44) CNR1TAS1R3TAS1R1CNR2

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-20100137401-A1 2-METHYLPROP ANAMIDES AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2010-06-03 US disclosed
US-20100137401-A1 2-METHYLPROP ANAMIDES AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2010-06-03 US disclosed
US-7687665-B2 2-(4-Chlorophenyl)-N-[(1R,2R)-2-(benzyloxy)cyclohexyl]-2-methylpropanamide; modulators of 11- beta hydroxyl steroid dehydrogenase type 1 and/or mineralocorticoid receptor INCYTE CORPORATION (US) 2010-03-30 US disclosed
US-7687665-B2 2-(4-Chlorophenyl)-N-[(1R,2R)-2-(benzyloxy)cyclohexyl]-2-methylpropanamide; modulators of 11- beta hydroxyl steroid dehydrogenase type 1 and/or mineralocorticoid receptor INCYTE CORPORATION (US) 2010-03-30 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-20100137401-A1 2-METHYLPROP ANAMIDES AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD3B1 P2RX7 3820/4885TRPV1 3619/4885CNR1 997/4885

“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.