SCHEMBL30735548

SCHEMBL30735548

CC(Oc1ccc(Oc2cnc3ccc(Br)cc3n2)cc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
LMNA P02545 4/20 0.60
CYP1A2 P05177 3/20 0.60
HPGD P15428 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
CYP3A4 P08684 2/20 0.60
MAPT P10636 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
TP53 P04637 1/20 0.60
ALOX15 P16050 1/20 0.60
NFKB1 P19838 1/20 0.60
HIF1A Q16665 1/20 0.60
GMNN O75496 1/20 0.60
APEX1 P27695 1/20 0.60
PMP22 Q01453 1/20 0.60
HTT P42858 8/20 0.43
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 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
SCHEMBL30946287 1.00 ALDH1A1 (0.60) ALDH1A1LMNACYP1A2HPGDNPSR1
SCHEMBL27259702 1.00 ALDH1A1 (0.60) ALDH1A1LMNACYP1A2HPGDNPSR1
SCHEMBL10971032 0.95 ALDH1A1 (0.54) ALDH1A1LMNACYP1A2HPGDNPSR1
SCHEMBL27259736 0.87 ALDH1A1 (0.61) ALDH1A1LMNACYP1A2HPGDNPSR1
SCHEMBL27259814 0.87 ALDH1A1 (0.61) ALDH1A1LMNACYP1A2HPGDNPSR1
SCHEMBL30946264 0.87 ALDH1A1 (0.61) ALDH1A1LMNACYP1A2HPGDNPSR1
SCHEMBL30946275 0.87 ALDH1A1 (0.61) ALDH1A1LMNACYP1A2HPGDNPSR1
R(+)Xk469 SCHEMBL31494114 0.86 ALDH1A1 (0.80) ALDH1A1LMNACYP1A2HPGDNPSR1
R(+)Xk469 SCHEMBL1958606 0.86 ALDH1A1 (0.80) ALDH1A1LMNACYP1A2HPGDNPSR1
R(+)Xk469 SCHEMBL10261981 0.86 ALDH1A1 (0.80) ALDH1A1LMNACYP1A2HPGDNPSR1

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
CN-117431002-A Water-based paint, shell, preparation method of shell and electronic equipment 捷开通讯(深圳)有限公司 2024-01-23 CN claimed
CN-117431002-A Water-based paint, shell, preparation method of shell and electronic equipment 捷开通讯(深圳)有限公司 2024-01-23 CN disclosed