SCHEMBL8145704

SCHEMBL8145704

CCn1c(=O)[nH]c(=O)c2cc(F)c(N3CCCC3)nc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
LMNA P02545 1/20 0.43
CYP2C9 P11712 1/20 0.43
ATP6V1B2 P21281 1/20 0.43
TBXA2R P21731 1/20 0.43
EDNRA P25101 1/20 0.43
TARBP2 Q15633 1/20 0.43
KDM4E B2RXH2 1/20 0.41
TMIGD3 P0DMS9 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PDE4A P27815 1/20 0.39
ADORA2A P29274 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
GAA P10253 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TPH1 P17752 5/20 0.35

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
SCHEMBL8153598 0.78 PDE4A (0.43) ALDH1A1LMNAKDM4ESMN1; SMN2PDE4A
SCHEMBL6801438 0.77 LMNA (0.43) ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL10770013 0.76 LMNA (0.43) ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL8150286 0.75 ALDH1A1 (0.46) ALDH1A1LMNAKDM4ERAB9AGAA
SCHEMBL6801066 0.71 LMNA (0.37) ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL6800912 0.69 ADORA1 (0.39) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9824594 0.69 LMNA (0.53) ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9825107 0.69 LMNA (0.53) ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9824232 0.69 LMNA (0.42) ALDH1A1LMNACYP2C9ATP6V1B2TBXA2R
SCHEMBL9824269 0.69 LMNA (0.42) LMNACYP2C9ATP6V1B2TBXA2REDNRA

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-1028950-A1 NOVEL 7-SUBSTITUTED QUINAZOLIN-2,4-DIONES USEFUL AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 2000-08-23 EP disclosed
WO-1999021840-A1 NOVEL 7-SUBSTITUTED QUINAZOLIN-2,4-DIONES USEFUL AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-05-06 WO disclosed