SCHEMBL847911

SCHEMBL847911

Cc1ccc(C(=O)C=Cc2ccc(Cl)nc2)c(Nc2ccccc2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 2/20 0.38
▸ HDAC4 P56524 2/20 0.38
▸ HDAC1 Q13547 2/20 0.38
▸ HDAC7 Q8WUI4 2/20 0.38
▸ HDAC2 Q92769 2/20 0.38
▸ HDAC10 Q969S8 2/20 0.38
▸ HDAC11 Q96DB2 2/20 0.38
▸ HDAC8 Q9BY41 2/20 0.38
▸ HDAC6 Q9UBN7 2/20 0.38
▸ HDAC9 Q9UKV0 2/20 0.38
▸ HDAC5 Q9UQL6 2/20 0.38
▸ PADI4 Q9UM07 1/20 0.38
▸ MAPK8 P45983 1/20 0.37
▸ EGFR P00533 3/20 0.37
▸ NFE2L2 Q16236 2/20 0.37
▸ BTK Q06187 2/20 0.37
▸ ABCG2 Q9UNQ0 6/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CYP1A1 P04798 1/20 0.36
▸ CYP1B1 Q16678 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
SCHEMBL846912 0.85 NPC1 (0.47) PADI4EGFRABCG2KMT2ACYP1A1
SCHEMBL847910 0.79 KMT2A (0.43) EGFRABCG2KMT2ALMNANPC1
SCHEMBL846959 0.77 FFAR1 (0.40) MAPK8KMT2AZAP70SYKLMNA
SCHEMBL9180282 0.72 MAOB (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8171612 0.72 DHODH (0.57) KMT2ALMNANPC1RAB9ASMN1; SMN2
SCHEMBL1733286 0.71 MAOA (0.67) KMT2ANPC1MAPK1RAB9ASMN1; SMN2
SCHEMBL1733285 0.71 MAOA (0.67) KMT2ANPC1MAPK1RAB9ASMN1; SMN2
SCHEMBL846982 0.71 MAPT (0.44) MAPK8KMT2ALMNANPC1MAPK1
SCHEMBL14617173 0.70 GAA (0.46) MAPK8EGFRKMT2AZAP70SYK
SCHEMBL10169191 0.70 MAPK8 (0.54) MAPK8EGFRKMT2AZAP70SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163906-B2 Dihydroquinone and dihydronaphthridine inhibitors of JNK ROCHE PALO ALTO, LLC (US) 2012-04-24 — — US disclosed
EP-2148862-B1 DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK HOFFMANN LA ROCHE (CH) 2012-03-28 — — EP disclosed
US-20080287458-A1 Dihydroquinone and dihydronaphthridine inhibitors of JNK ROCHE PALO ALTO LLC 2008-11-20 — — 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-20080287458-A1 Dihydroquinone and dihydronaphthridine inhibitors of JNK MAPK9, MAPK10, MAPK1 HDAC3 550/4885HDAC4 2632/4885HDAC1 1169/4885

“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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