SCHEMBL14995555

SCHEMBL14995555

O=C(O)c1cc(-c2cc(F)cc(Cl)c2)n(-c2ccccn2)n1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MARS1 P56192 6/20 0.64
▸ KMT2A Q03164 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ RPA1 P27694 4/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PPP1CA P62136 3/20 0.46
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HTT P42858 1/20 0.43

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
SCHEMBL27714804 0.84 MARS1 (0.67) MARS1KMT2AMEN1L3MBTL1ATM
SCHEMBL15004267 0.84 KMT2A (0.50) MARS1KMT2AMEN1L3MBTL1ATM
SCHEMBL14995556 0.84 MARS1 (0.45) MARS1KMT2AMEN1ALDH1A1
SCHEMBL15004326 0.81 MARS1 (0.44) MARS1KMT2AMEN1ALDH1A1MAPT
SCHEMBL14995433 0.80 KMT2A (0.62) MARS1KMT2AMEN1L3MBTL1ATM
SCHEMBL1765012 0.80 PPP1CA (0.71) MARS1KMT2AMEN1L3MBTL1ATM
SCHEMBL15004255 0.80 KMT2A (0.56) MARS1KMT2AMEN1L3MBTL1ATM
SCHEMBL14995357 0.79 MARS1 (0.64) MARS1KMT2AMEN1L3MBTL1ATM
SCHEMBL14995625 0.78 KMT2A (0.54) MARS1KMT2AMEN1L3MBTL1ATM
SCHEMBL117374 0.78 MARS1 (1.00) MARS1L3MBTL1RPA1

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 MARS1 752/4885KMT2A 621/4885MEN1 2710/4885

“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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