SCHEMBL20108994

SCHEMBL20108994

Cc1ccc(CNC(=O)c2cc(CC(C)C)nn2C)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ PPARG P37231 4/20 0.49
▸ PPARD Q03181 4/20 0.49
▸ PPARA Q07869 4/20 0.49
▸ WDR5 P61964 2/20 0.46
▸ PHGDH O43175 1/20 0.42
▸ GALR3 O60755 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ NR2F2 P24468 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HPGD P15428 1/20 0.40
▸ CNR1 P21554 3/20 0.40
▸ CNR2 P34972 3/20 0.40
▸ TP53 P04637 1/20 0.40

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
SCHEMBL18112681 0.80 GALR3 (0.64) L3MBTL1PPARGPPARDPPARAWDR5
SCHEMBL21683294 0.76 L3MBTL1 (0.47) L3MBTL1PPARGPPARDPPARAPHGDH
SCHEMBL21702505 0.72 L3MBTL1 (0.43) L3MBTL1PPARGPPARDPPARAPHGDH
SCHEMBL21702468 0.72 HDAC4 (0.46) L3MBTL1PPARGPPARDPPARAPHGDH
SCHEMBL18251688 0.70 ERCC1 (0.60) WDR5SMN1; SMN2HPGD
SCHEMBL27788500 0.70 ACKR3 (0.37) HPGD
SCHEMBL18124522 0.69 MEN1 (0.48) L3MBTL1PPARGPPARDPPARAPHGDH
SCHEMBL10925245 0.68 TSHR (0.54) WDR5RAB9ASMN1; SMN2KMT2AHPGD
SCHEMBL2215247 0.68 GRN (0.49) PHGDHHPGD
SCHEMBL1150723 0.68 WDR5 (0.46) L3MBTL1WDR5HPGDCNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180118679-A1 N-Methyl Pyrazoles Prosetta Antiviral ,Inc. 2018-05-03 — — 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-20180118679-A1 N-Methyl Pyrazoles ZC3HAV1, MAVS, NNMT L3MBTL1 385/4885PPARG 2055/4885PPARD 1098/4885

“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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