SCHEMBL29535209

SCHEMBL29535209

Nc1ccc(Oc2ccc(Oc3ccc(Oc4ccc(N)cc4)c(Oc4ccc(N)cc4)c3)cc2Oc2ccc(N)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.64
TDP1 Q9NUW8 2/20 0.64
CYP3A4 P08684 1/20 0.64
TSHR P16473 1/20 0.64
MAPT P10636 5/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
MITF O75030 1/20 0.61
GAA P10253 1/20 0.61
GFER P55789 1/20 0.61
NLRP1 Q9C000 1/20 0.61
NOD2 Q9HC29 1/20 0.61
MAOA P21397 2/20 0.54
TEAD4 Q15561 1/20 0.52
MAOB P27338 1/20 0.52
POLB P06746 1/20 0.50
MAPK1 P28482 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48

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
SCHEMBL28718997 1.00 ALDH1A1 (0.64) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL487016 0.81 MAOA (0.73) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL486843 0.81 MAOA (0.73) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL6290540 0.81 MAOA (0.73) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL2048299 0.81 ALDH1A1 (0.70) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL1271001 0.81 ALDH1A1 (0.80) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL7187813 0.81 MAOA (0.57) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL20854262 0.81 ALDH1A1 (0.59) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL177818 0.81 SMN1; SMN2 (0.61) ALDH1A1TDP1CYP3A4TSHRMAPT
SCHEMBL6289400 0.81 ALDH1A1 (0.80) ALDH1A1TDP1CYP3A4TSHRMAPT

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
CN-114253076-A Photosensitive resin composition 旭化成株式会社 2022-03-29 CN disclosed