SCHEMBL26048508

SCHEMBL26048508

Cc1ccc(Nc2cncc3ccn(CC=O)c(=O)c23)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAP2K1 Q02750 13/20 0.41
▸ KDR P35968 2/20 0.40
▸ FLT1 P17948 1/20 0.40
▸ P2RX7 Q99572 1/20 0.37
▸ MAP2K2 P36507 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.32
▸ SYK P43405 1/20 0.32
▸ HDAC3 O15379 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL24407575 0.84 FLT1 (0.43) MAP2K1KDRFLT1P2RX7MAP2K2
SCHEMBL24407548 0.84 MAP2K1 (0.40) MAP2K1KDRFLT1P2RX7MAP2K2
SCHEMBL26047568 0.84 MAP2K1 (0.46) MAP2K1KDRFLT1P2RX7MAP2K2
SCHEMBL24407530 0.84 FLT1 (0.42) MAP2K1KDRFLT1P2RX7MAP2K2
SCHEMBL24407573 0.82 MAP2K1 (0.60) MAP2K1MAP2K2
SCHEMBL26047554 0.82 MAP2K1 (0.60) MAP2K1MAP2K2
SCHEMBL24407522 0.82 MAP2K1 (0.60) MAP2K1MAP2K2
SCHEMBL24407549 0.81 MAP2K1 (0.44) MAP2K1KDRFLT1P2RX7MAP2K2
SCHEMBL24407571 0.78 ALDH1A1 (0.38) MAP2K1KDRFLT1
SCHEMBL26048477 0.78 ALDH1A1 (0.38) MAP2K1KDRFLT1

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-4233865-A2 ARYL-ANILINE AND HETEROARYL-ANILINE COMPOUNDS FOR TREATMENT OF SKIN CANCERS NFlection Therapeutics, Inc. (US) 2023-08-30 — — EP disclosed
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