SCHEMBL25548

SCHEMBL25548

Cc1ccc(C(=O)NC2CC2)cc1O

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.58
MAPK11 Q15759 5/20 0.53
HSPB1 P04792 1/20 0.53
CYP2C9 P11712 1/20 0.53
RAB9A P51151 5/20 0.53
NPC1 O15118 4/20 0.53
HPGD P15428 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SMYD3 Q9H7B4 1/20 0.52
CNR2 P34972 1/20 0.50
KMT2A Q03164 1/20 0.50
LCK P06239 1/20 0.50
CSF1R P07333 1/20 0.50
KDR P35968 1/20 0.50

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
SCHEMBL10282601 0.86 GLA (0.64) MAPK14MAPK11HSPB1CYP2C9RAB9A
SCHEMBL13068954 0.84 MAPK1 (0.47) MAPK14RAB9ASMYD3KMT2AKDR
SCHEMBL2948427 0.83 MAPK14 (0.58) MAPK14MAPK11HSPB1CYP2C9RAB9A
SCHEMBL178451 0.82 HDAC1 (0.63) MAPK14MAPK11HSPB1CYP2C9RAB9A
SCHEMBL2974767 0.82 MAPK14 (0.57) MAPK14MAPK11HSPB1CYP2C9RAB9A
SCHEMBL178414 0.82 MAPK14 (0.60) MAPK14MAPK11HSPB1CYP2C9RAB9A
SCHEMBL178563 0.82 MEN1 (0.68) MAPK14MAPK11HSPB1CYP2C9RAB9A
SCHEMBL11965675 0.81 MAPK14 (0.61) MAPK14MAPK11HSPB1CYP2C9
SCHEMBL12217594 0.81 RAB9A (0.62) CYP2C9RAB9ANPC1HPGDCYP1A2
SCHEMBL13146407 0.81 MAPK14 (0.56) MAPK14MAPK11HSPB1CYP2C9RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2385041-B1 Pyrazole-amine compounds useful as kinase inhibitors BRISTOL MYERS SQUIBB CO (US) 2013-09-18 EP disclosed
US-8080546-B2 Pyrazolo-pyridinone derivatives and methods of use AMGEN INC. (US) 2011-12-20 US disclosed
EP-2385041-A1 Pyrazole-amine compounds useful as kinase inhibitors Bristol-Myers Squibb Company (US) 2011-11-09 EP disclosed
US-8041794-B2 Platform discovery, asset inventory, configuration, and provisioning in a pre-boot environment using web services INTEL CORPORATION (US) 2011-10-18 US disclosed
US-7592338-B2 Pyrazole-amine compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-09-22 US disclosed
US-20090137582-A1 Pyrazolo-pyridinone derivatives and methods of use AMGEN INC. (US) 2009-05-28 US disclosed
WO-2009055033-A1 PYRAZOLO-PYRIDINONE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2009-04-30 WO disclosed
EP-1620108-A4 PYRAZOLE-AMINE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2008-08-27 EP disclosed
US-20080004278-A1 (1-phenyl-5-propyl-1H-pyrazol-4-yl)-(3-amino-N-cyclopropyl-4-methyl-benzamide)-amine; p38 mitogen-activated protein kinase inhibitor; reduced levels of TNF- alpha expression; antiinfammatory agent: rheumatoid arthritis, psoriasis, multiple sclerosis, endotoxin shock, osteoporosis, Alzheimer's disease BRISTOL-MYERS SQUIBB COMPANY 2008-01-03 US disclosed
US-7253170-B2 Pyrazole-amine compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-08-07 US disclosed
US-7151113-B2 Pyrazole-amine compounds useful as kinase inhibitors BRISTOL MYERS SQUIBB COMPANY (US) 2006-12-19 US disclosed
US-20060247247-A1 Pyrazole-amine compounds useful as kinase inhibitors DYCKMAN ALARIC J 2006-11-02 US disclosed
EP-1620108-A2 PYRAZOLE-AMINE COMPOUNDS USEFUL AS KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2006-02-01 EP disclosed
US-20040248853-A1 Pyrazole-amine compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-12-09 US disclosed
WO-2004098528-A2 PYRAZOLE-AMINE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-11-18 WO 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 (4 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-20040248853-A1 Pyrazole-amine compounds useful as kinase inhibitors MAPK1, MAP3K1, MAP3K5 MAPK14 57/4885MAPK11 55/4885HSPB1 1779/4885
US-20090137582-A1 Pyrazolo-pyridinone derivatives and methods of use IL1B, IL1R1, IL1A MAPK14 52/4885MAPK11 177/4885HSPB1 1721/4885
US-20080004278-A1 (1-phenyl-5-propyl-1H-pyrazol-4-yl)-(3-amino-N-cyclopropyl-4-methyl-benzamide)-amine; p38 mitogen-activated protein kinase inhibitor; reduced levels of TNF- alpha expression; antiinfammatory agent: rheumatoid arthritis, psoriasis, multiple sclerosis, endotoxin shock, osteoporosis, Alzheimer's disease MAPK1, MAPK3, MAPK4 MAPK14 11/4885MAPK11 28/4885HSPB1 491/4885
US-20060247247-A1 Pyrazole-amine compounds useful as kinase inhibitors MAP3K1, MAP3K20, MAP3K5 MAPK14 56/4885MAPK11 48/4885HSPB1 2831/4885

“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.