SCHEMBL30353540

SCHEMBL30353540

Cc1cccc(N2C(=O)Cc3c(OCc4cccnc4)nc(N4CCOCC4)nc32)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 6/20 0.44
▸ PIK3CA P42336 5/20 0.43
▸ PIK3CD O00329 3/20 0.43
▸ P2RY12 Q9H244 1/20 0.43
▸ PIK3CB P42338 1/20 0.43
▸ PIK3CG P48736 1/20 0.43
▸ RAD52 P43351 1/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ PIK3R1 P27986 2/20 0.39
▸ CSNK1D P48730 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HRH4 Q9H3N8 1/20 0.38

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
SCHEMBL30353531 1.00 PRKDC (0.44) PRKDCPIK3CAPIK3CDP2RY12PIK3CB
SCHEMBL25618870 1.00 PRKDC (0.44) PRKDCPIK3CAPIK3CDP2RY12PIK3CB
SCHEMBL25270177 0.77 PIK3CD (0.44) PRKDCPIK3CAPIK3CDP2RY12PIK3CB
SCHEMBL30353528 0.77 PIK3CD (0.44) PRKDCPIK3CAPIK3CDP2RY12PIK3CB
SCHEMBL25617735 0.76 PIK3CA (0.63) PRKDCPIK3CAPIK3R1
SCHEMBL31547941 0.76 PIK3CA (0.63) PRKDCPIK3CAPIK3R1
SCHEMBL31547982 0.75 PIK3CA (0.57) PIK3CAPIK3R1ALDH1A1MAPK1
SCHEMBL24099574 0.75 PIK3CA (0.57) PIK3CAPIK3R1ALDH1A1MAPK1
SCHEMBL30353544 0.74 PIK3CA (0.54) PIK3CAPIK3R1CSNK1D
SCHEMBL25617472 0.74 PIK3CA (0.54) PIK3CAPIK3R1CSNK1D

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
EP-4444317-A2 BICYCLIC HETEROARENES AND METHODS OF THEIR USE Kineta, Inc. (US) 2024-10-16 — — EP disclosed
WO-2023107623-A2 BICYCLIC HETEROARENES AND METHODS OF THEIR USE Kineta, Inc. (US) 2023-06-15 — — WO disclosed
EP-4161523-A1 BICYCLIC HETEROARENES AND METHODS OF THEIR USE Yumanity Therapeutics, Inc. (US) 2023-04-12 — — EP disclosed
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