SCHEMBL3947648

SCHEMBL3947648

O=C1NC(=O)c2ccc3c4c(-c5ccccc5)c(-c5ccccc5)c5c6c(ccc(c7ccc1c2c73)c64)C(=O)NC5=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 12/20 0.43
▸ CHEK1 O14757 10/20 0.43
▸ PARP1 P09874 3/20 0.42
▸ CDK4 P11802 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ PRKD3 O94806 2/20 0.40
▸ PRKCG P05129 2/20 0.40
▸ PRKCB P05771 2/20 0.40
▸ PRKCA P17252 2/20 0.40
▸ PRKCH P24723 2/20 0.40
▸ PRKCI P41743 2/20 0.40
▸ PRKCE Q02156 2/20 0.40
▸ PRKCQ Q04759 2/20 0.40
▸ PRKCZ Q05513 2/20 0.40
▸ PRKCD Q05655 2/20 0.40
▸ PRKD1 Q15139 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ TNIK Q9UKE5 1/20 0.40
▸ CCND1 P24385 3/20 0.40

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
SCHEMBL5014177 0.84 WEE1 (0.47) WEE1CHEK1PARP1CDK4MEN1
SCHEMBL9314360 0.82 WEE1 (0.39) WEE1CHEK1PARP1CDK4CCND1
SCHEMBL16855803 0.81 PARP1 (0.49) CHEK1PARP1CDK4MEN1KMT2A
SCHEMBL12031536 0.80 PARP1 (0.42) WEE1CHEK1PARP1CDK4MEN1
SCHEMBL8665025 0.79 PARP1 (0.47) WEE1CHEK1PARP1CDK4MEN1
SCHEMBL7601076 0.75 PARP1 (0.50) WEE1CHEK1PARP1MEN1KMT2A
SCHEMBL29541 0.75 PARP1 (0.50) WEE1CHEK1PARP1MEN1KMT2A
SCHEMBL7598089 0.75 PARP1 (0.50) WEE1CHEK1PARP1MEN1KMT2A
SCHEMBL30606639 0.75 PARP1 (0.50) WEE1CHEK1PARP1MEN1KMT2A
SCHEMBL2785287 0.74 MAOA (0.39) WEE1CHEK1PARP1CDK4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2052423-A1 THE USE OF PERYLENE DIIMIDE DERIVATIVES AS AIR-STABLE N-CHANNEL ORGANIC SEMICONDUCTORS BASF SE (DE) 2009-04-29 — — EP disclosed
WO-2008017714-A1 THE USE OF PERYLENE DIIMIDE DERIVATIVES AS AIR-STABLE N-CHANNEL ORGANIC SEMICONDUCTORS BASF SE (DE) 2008-02-14 — — WO disclosed
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