SCHEMBL24508237

SCHEMBL24508237

Oc1ccc2ccc3ccc(Br)nc3c2n1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.34
RAB9A P51151 1/20 0.33
CCR5 P51681 1/20 0.33

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
SCHEMBL57528 0.84 CCR1 (0.43) CCR1RAB9ACCR5
SCHEMBL6844002 0.84 CCR1 (0.43) CCR1RAB9ACCR5
SCHEMBL31493925 0.82 CCR1 (0.42) CCR1RAB9ACCR5
SCHEMBL6065573 0.73 METAP2 (0.59) RAB9A
SCHEMBL5763166 0.73 BACE1 (0.59) CCR1RAB9ACCR5
SCHEMBL14884180 0.72 CCR1 (0.33) CCR1RAB9ACCR5
SCHEMBL6221465 0.71 KDM4E (0.35) CCR1CCR5
SCHEMBL16827263 0.71 MAPT (0.34)
SCHEMBL28428682 0.68 KDM4E (0.32) RAB9A
SCHEMBL4459734 0.68 PTPN22 (0.39)

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
WO-2022124502-A1 ORGANIC COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND LG Display Co.,Ltd. (KR) 2022-06-16 WO disclosed