SCHEMBL9042960

SCHEMBL9042960

COc1ccc(N)c2c1N(Cc1ccccc1)CCC2=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ PDE4A P27815 2/20 0.41
▸ PDE4B Q07343 2/20 0.41
▸ PDE4C Q08493 2/20 0.41
▸ PDE4D Q08499 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ DDB1 Q16531 1/20 0.41
▸ CRBN Q96SW2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ FGB P02675 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ PPARG P37231 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NCOA2 Q15596 1/20 0.41
▸ NCOA1 Q15788 1/20 0.41

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
SCHEMBL29032652 0.73 TUBB4A (0.47) PDE4APDE4BPDE4CPDE4DDDB1
SCHEMBL9404866 0.72 LMNA (0.47) MAPTLMNAPDE4APDE4BPDE4C
SCHEMBL11486215 0.68 EZH2 (0.47) PDE4APDE4BPDE4CPDE4DDDB1
SCHEMBL8248998 0.67 DDB1 (0.59) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL11486292 0.67 GRM5 (0.46) LMNAALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL31134765 0.66 GRM5 (0.60) PDE4APDE4DMEN1KMT2ACYP3A4
SCHEMBL6326889 0.66 GRM5 (0.48) LMNAPOLBKMT2ASMN1; SMN2CYP3A4
SCHEMBL16495324 0.65 DDB1 (0.49) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL10877473 0.65 ACHE (0.53) ALDH1A1POLBMEN1RAB9AKMT2A
SCHEMBL32691557 0.65 GRM5 (0.47) PDE4APDE4BPDE4CPDE4DALDH1A1

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-0471358-B1 Fluoroethylcamptothecin derivatives KYORIN SEIYAKU KK (JP) 1996-05-08 — — EP disclosed
EP-0471358-A1 Fluoroethylcamptothecin derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 1992-02-19 — — EP disclosed
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