SCHEMBL19986863

SCHEMBL19986863

CCCN1CCN(Cc2ccc(C(=O)Nc3ccc(C)c(NCc4cnc(NC(=O)C5CC5)cn4)c3)cc2C(F)(F)F)CC1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.71
▸ ABL1 P00519 2/20 0.57
▸ HCK P08631 1/20 0.56
▸ NR2C2 P49116 1/20 0.56
▸ EGFR P00533 5/20 0.56
▸ BRAF P15056 5/20 0.56
▸ DDR1 Q08345 1/20 0.55
▸ CSF1R P07333 4/20 0.54
▸ KIT P10721 4/20 0.54

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
SCHEMBL17208642 0.94 RAD52 (0.79) RAD52ABL1HCKNR2C2DDR1
SCHEMBL17208643 0.92 RAD52 (0.67) RAD52ABL1EGFRBRAF
SCHEMBL2226738 0.87 RAD52 (0.82) RAD52NR2C2EGFRBRAFDDR1
SCHEMBL16588513 0.86 RAD52 (0.71) RAD52ABL1EGFRBRAFDDR1
SCHEMBL19986849 0.86 RAD52 (0.81) RAD52HCKNR2C2DDR1
SCHEMBL17208720 0.85 RAD52 (0.95) RAD52NR2C2DDR1
SCHEMBL17208696 0.85 RAD52 (0.80) RAD52NR2C2DDR1
SCHEMBL22457642 0.84 RAD52 (0.78) RAD52NR2C2DDR1
SCHEMBL2228555 0.84 RAD52 (0.84) RAD52NR2C2DDR1
SCHEMBL2280193 0.82 RAD52 (0.75) RAD52HCKNR2C2EGFRBRAF

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
EP-2937345-B1 TYPE II RAF KINASE INHIBITORS DANA FARBER CANCER INST INC (US) 2018-03-21 — — EP disclosed
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