SCHEMBL10124513

SCHEMBL10124513

FC(F)(F)c1ccc2[nH]ncc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 2/20 0.44
▸ AXL P30530 1/20 0.41
▸ TRPA1 O75762 9/20 0.40
▸ TRPM8 Q7Z2W7 3/20 0.40
▸ HSP90AA1 P07900 1/20 0.36
▸ IDO1 P14902 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ NOS1 P29475 4/20 0.36
▸ MAPT P10636 2/20 0.36
▸ CSNK2A1 P68400 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ROCK2 O75116 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ROCK1 Q13464 1/20 0.36
▸ HIF1A Q16665 1/20 0.36

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
SCHEMBL29626644 1.00 METAP2 (0.44) METAP2AXLTRPA1TRPM8HSP90AA1
SCHEMBL13208472 0.81 TRPA1 (0.40) METAP2TRPA1HSP90AA1IDO1CDK2
SCHEMBL21951135 0.74 NOS1 (0.48) METAP2HSP90AA1IDO1CDK2NOS1
SCHEMBL31414356 0.74 HSP90AA1 (0.40) METAP2TRPA1HSP90AA1IDO1CDK2
SCHEMBL460550 0.74 HSP90AA1 (0.40) METAP2TRPA1HSP90AA1IDO1CDK2
SCHEMBL30166995 0.71 MAOB (0.36) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL14630014 0.71 MAOB (0.36) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL8296672 0.69 RAB9A (0.41) METAP2TRPA1HSP90AA1IDO1CDK2
SCHEMBL503223 0.69 NOS1 (0.48) METAP2AXLHSP90AA1IDO1CDK2
SCHEMBL22941283 0.69 HSP90AA1 (0.40) METAP2HSP90AA1IDO1CDK2NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220387395-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION NURIX THERAPEUTICS, INC. 2022-12-08 — — US disclosed
CN-114450271-A Ureas, amino and substituted heteroaryl compounds for Cbl-b inhibition 纽力克斯治疗公司 2022-05-06 — — CN disclosed
WO-2018080918-A1 3-ARYL-2H-PYRAZOLO[4,3-B]PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 — — WO disclosed
US-20180111925-A1 3-ARYL-2H-PYRAZOLO[4,3-b]PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-04-26 — — US disclosed
EP-2655371-B1 PYRAZOLOPIPERIDINE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2015-02-25 — — EP disclosed
US-8546442-B2 Pyrazolopiperidine compounds as CCR1 receptor antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-01 — — US disclosed
US-8546442-B2 Pyrazolopiperidine compounds as CCR1 receptor antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-01 — — US disclosed
US-20120322790-A1 Pyrazolopiperidine Compounds As CCR1 Receptor Antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-12-20 — — US disclosed
US-20120322790-A1 Pyrazolopiperidine Compounds As CCR1 Receptor Antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-12-20 — — US disclosed
WO-2012087782-A1 PYRAZOLOPIPERIDINE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-28 — — 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 (3 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-20180111925-A1 3-ARYL-2H-PYRAZOLO[4,3-b]PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS GRIN3A, GRIN3B, GRIN2B METAP2 4450/4885AXL 142/4885TRPA1 540/4885
US-20120322790-A1 Pyrazolopiperidine Compounds As CCR1 Receptor Antagonists CCR1, CCR3, CCR4 METAP2 1274/4885AXL 4005/4885TRPA1 157/4885
US-20220387395-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION CBLB, CBL, CBLC METAP2 2207/4885AXL 328/4885TRPA1 4879/4885

“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.

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