SCHEMBL12098596

SCHEMBL12098596

Nc1ccc(Oc2ccc(Oc3ccc(-c4ccc(Oc5ccc(Oc6ccc(N)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.82
TDP1 Q9NUW8 5/20 0.82
CYP3A4 P08684 3/20 0.82
TSHR P16473 1/20 0.82
MAOA P21397 2/20 0.67
TP53 P04637 1/20 0.65
MAPT P10636 5/20 0.64
TEAD4 Q15561 1/20 0.64
MAOB P27338 1/20 0.64
SMN1; SMN2 Q16637 3/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
POLB P06746 1/20 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
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56

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
SCHEMBL7144807 1.00 ALDH1A1 (0.82) ALDH1A1TDP1CYP3A4TSHRMAOA
SCHEMBL8827988 1.00 ALDH1A1 (0.82) ALDH1A1TDP1CYP3A4TSHRMAOA
SCHEMBL1271568 1.00 ALDH1A1 (0.82) ALDH1A1TDP1CYP3A4TSHRMAOA
SCHEMBL64458 1.00 ALDH1A1 (0.82) ALDH1A1TDP1CYP3A4TSHRMAOA
SCHEMBL3482529 1.00 ALDH1A1 (0.82) ALDH1A1TDP1CYP3A4TSHRMAOA
SCHEMBL3482671 1.00 ALDH1A1 (0.82) ALDH1A1TDP1CYP3A4TSHRMAOA
Hydrochloric Acid SCHEMBL8642994 0.97 ALDH1A1 (0.78) ALDH1A1TDP1CYP3A4TSHRMAOA
Ammonia Solution, Strong SCHEMBL8013462 0.97 ALDH1A1 (0.78) ALDH1A1TDP1CYP3A4TSHRMAOA
Water SCHEMBL5479194 0.97 ALDH1A1 (0.78) ALDH1A1TDP1CYP3A4TSHRMAOA
Water SCHEMBL28256237 0.97 ALDH1A1 (0.78) ALDH1A1TDP1CYP3A4TSHRMAOA

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-2725423-A1 NEGATIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION, PATTERN FORMING METHOD, CURED FILM, INSULATING FILM, COLOR FILTER, AND DISPLAY DEVICE Tokyo Ohka Kogyo Co., Ltd. (JP) 2014-04-30 EP disclosed
US-20120228784-A1 SEMICONDUCTOR DEVICE SUMITOMO BAKELITE CO., LTD. (JP) 2012-09-13 US disclosed