SCHEMBL14995433

SCHEMBL14995433

O=C(O)c1cc(-c2cc(F)cc(Cl)c2)n(-c2ccncc2)n1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ ATM Q13315 1/20 0.62
▸ RPA1 P27694 5/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ PPP1CA P62136 4/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ MARS1 P56192 3/20 0.49
▸ RXRA P19793 1/20 0.48
▸ RXRB P28702 1/20 0.48
▸ RXRG P48443 1/20 0.48

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
SCHEMBL15004255 0.87 KMT2A (0.56) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL14995357 0.86 MARS1 (0.64) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL1765012 0.85 PPP1CA (0.71) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL15004318 0.85 KMT2A (0.56) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL14995625 0.85 KMT2A (0.54) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL1526212 0.84 RPA1 (0.61) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL15004320 0.83 KMT2A (0.52) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL14995579 0.82 MEN1 (0.51) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL15004402 0.82 KMT2A (0.59) KMT2AMEN1ATMRPA1SMN1; SMN2
SCHEMBL14995435 0.82 RXRA (0.46) KMT2AMEN1ATMRPA1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9296720-B2 Carboxamide-substituted heteroaryl-pyrazoles and the use thereof AICURIS GMBH & CO. KG (DE) 2016-03-29 — — US disclosed
US-9296720-B2 Carboxamide-substituted heteroaryl-pyrazoles and the use thereof AICURIS GMBH & CO. KG (DE) 2016-03-29 — — US disclosed
US-9296720-B2 Carboxamide-substituted heteroaryl-pyrazoles and the use thereof AICURIS GMBH & CO. KG (DE) 2016-03-29 — — US disclosed
US-20150105388-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF AICURIS GMBH & CO. KG (DE) 2015-04-16 — — US disclosed
US-20150105388-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF AICURIS GMBH & CO. KG (DE) 2015-04-16 — — US disclosed
US-20150105388-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF AICURIS GMBH & CO. KG (DE) 2015-04-16 — — US disclosed
EP-2785705-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF AiCuris GmbH & Co. KG (DE) 2014-10-08 — — EP disclosed
WO-2013079586-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF AICURIS GMBH & CO. KG (DE) 2013-06-06 — — WO disclosed
WO-2013079586-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF AICURIS GMBH & CO. KG (DE) 2013-06-06 — — 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 (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-20150105388-A1 CARBOXAMIDE-SUBSTITUTED HETEROARYL-PYRAZOLES AND THE USE THEREOF PAICS, AADAC, TPMT KMT2A 621/4885MEN1 2710/4885ATM 4615/4885

“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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