SCHEMBL24713792

SCHEMBL24713792

Clc1ccc2c(ccc3c4cc5c(cc4[nH]c23)[nH]c2c3ccc(Cl)cc3ccc52)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.43
▸ F11 P03951 1/20 0.42
▸ PARP1 P09874 1/20 0.41
▸ TP53 P04637 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ AR P10275 1/20 0.39
▸ CCNE2 O96020 1/20 0.39
▸ CDK4 P11802 1/20 0.39
▸ CCND1 P24385 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ CAMK2B Q13554 1/20 0.39
▸ CAMK2G Q13555 1/20 0.39
▸ CAMK2D Q13557 1/20 0.39
▸ CAMK2A Q9UQM7 1/20 0.39
▸ TYMS P04818 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CYP2A6 P11509 1/20 0.38
▸ MAT2A P31153 2/20 0.37
▸ AHR P35869 2/20 0.37

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
SCHEMBL24713737 0.94 KIF11 (0.44) KIF11F11PARP1TP53SMN1; SMN2
SCHEMBL24713728 0.84 CYP2A6 (0.43) KIF11F11PARP1TP53SMN1; SMN2
SCHEMBL24032467 0.82 KIF11 (0.68) KIF11CCNE2CDK4CCND1CCNE1
SCHEMBL24713750 0.81 F11 (0.46) KIF11F11SMN1; SMN2CCNE2CDK4
SCHEMBL24713797 0.81 GABRP (0.42) KIF11F11SMN1; SMN2CCNE2CDK4
SCHEMBL24032466 0.79 KIF11 (0.68) KIF11PARP1TP53SMN1; SMN2CCNE2
SCHEMBL24032327 0.77 KIF11 (0.66) KIF11SMN1; SMN2CCNE2CDK4CCND1
SCHEMBL22155093 0.76 KIF11 (0.50) KIF11PARP1TP53SMN1; SMN2CCNE2
SCHEMBL22440894 0.75 KDM4E (0.51) LMNAKDM4EMEN1HPGDKMT2A
SCHEMBL16433002 0.74 CHUK (0.52) PARP1CCNE2CDK4CCND1CCNE1

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-4063367-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME LG Chem, Ltd. (KR) 2022-09-28 — — EP disclosed
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