SCHEMBL7728937

SCHEMBL7728937

Cc1ccc2c(F)c(C(=O)O)sc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.67
BCL2L1 Q07817 1/20 0.67
BCKDK O14874 2/20 0.50
NPC1 O15118 5/20 0.47
RAB9A P51151 5/20 0.47
MAPT P10636 4/20 0.47
LMNA P02545 2/20 0.47
GAA P10253 1/20 0.47
GPR35 Q9HC97 1/20 0.46
RXFP1 Q9HBX9 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
NPSR1 Q6W5P4 2/20 0.41
PPARG P37231 1/20 0.41
NR2E3 Q9Y5X4 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
ESR1 P03372 1/20 0.41
RPA1 P27694 2/20 0.40
TBXAS1 P24557 1/20 0.40
PKM P14618 2/20 0.40
OPRM1 P35372 2/20 0.39

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
SCHEMBL6404079 0.87 MCL1 (0.54) MCL1BCL2L1BCKDKNPC1RAB9A
SCHEMBL15619574 0.83 MCL1 (0.71) MCL1BCL2L1BCKDKNPC1RAB9A
SCHEMBL20559686 0.83 BCKDK (0.71) MCL1BCL2L1BCKDKNPC1RAB9A
SCHEMBL16573127 0.81 BCKDK (0.48) MCL1BCL2L1BCKDKNPC1RAB9A
SCHEMBL9259610 0.81 MCL1 (0.63) MCL1BCL2L1BCKDKNPC1RAB9A
SCHEMBL417349 0.80 MCL1 (1.00) MCL1BCL2L1BCKDKNPC1RAB9A
SCHEMBL16693177 0.80 BCKDK (0.50) MCL1BCL2L1BCKDKNPC1RAB9A
SCHEMBL4277521 0.80 MCL1 (0.67) MCL1BCL2L1BCKDKNPC1RAB9A
SCHEMBL2610280 0.80 MCL1 (0.61) MCL1BCL2L1BCKDKNPC1RAB9A
Hydrochloric Acid SCHEMBL11398368 0.79 MCL1 (0.97) MCL1BCL2L1BCKDKNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233087-A1 GEMINAL SUBSTITUTED QUINUCLIDINE AMIDE COMPOUNDS AS AGONISTS OF ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTORS Axovant Sciences GmbH (DE) 2017-10-25 EP disclosed
WO-2016100184-A1 GEMINAL SUBSTITUTED QUINUCLIDINE AMIDE COMPOUNDS AS AGONISTS OF ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTORS FORUM PHARMACEUTICALS, INC. (US) 2016-06-23 WO disclosed
US-8426401-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV 2013-04-23 US disclosed
US-8426401-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV 2013-04-23 US disclosed
US-20100324011-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-23 US disclosed
US-20100324011-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-23 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-20100324011-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA MCL1 2183/4885BCL2L1 3024/4885BCKDK 742/4885

“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.