SCHEMBL24550784

SCHEMBL24550784

Clc1ccc2oc3cc4nc(-c5ccccc5)oc4cc3c2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.71
▸ CASP3 P42574 4/20 0.71
▸ SENP7 Q9BQF6 4/20 0.71
▸ SENP6 Q9GZR1 3/20 0.71
▸ KDM4E B2RXH2 6/20 0.55
▸ NPC1 O15118 6/20 0.55
▸ RAB9A P51151 6/20 0.55
▸ HPGD P15428 3/20 0.55
▸ POLB P06746 3/20 0.55
▸ SENP8 Q96LD8 2/20 0.55
▸ ALDH1A1 P00352 3/20 0.52
▸ LMNA P02545 1/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ NFKB2 Q00653 1/20 0.52
▸ RELA Q04206 1/20 0.52
▸ NPSR1 Q6W5P4 2/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ PTPN2 P17706 3/20 0.49

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
SCHEMBL24551507 0.94 SMN1; SMN2 (0.71) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL24550880 0.92 SMN1; SMN2 (0.68) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL24550588 0.92 SMN1; SMN2 (0.67) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL24550527 0.89 SMN1; SMN2 (0.63) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL26450320 0.88 SMN1; SMN2 (0.54) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL24551452 0.87 SMN1; SMN2 (0.53) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL24552257 0.86 SMN1; SMN2 (0.67) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL30729297 0.84 SMN1; SMN2 (1.00) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL2141073 0.84 SMN1; SMN2 (1.00) SMN1; SMN2CASP3SENP7SENP6KDM4E
SCHEMBL27107585 0.83 SMN1; SMN2 (0.59) SMN1; SMN2CASP3SENP7SENP6KDM4E

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-4258372-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-10-11 — — EP disclosed
WO-2022131869-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-06-23 — — WO disclosed
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