SCHEMBL4103477

SCHEMBL4103477

Nc1ccc(Oc2ccc(OCCOc3ccc(Oc4ccc(N)cc4)cc3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.70
▸ TDP1 Q9NUW8 4/20 0.70
▸ TSHR P16473 2/20 0.70
▸ CYP3A4 P08684 1/20 0.70
▸ LTA4H P09960 2/20 0.61
▸ PTGS1 P23219 1/20 0.61
▸ PTGS2 P35354 1/20 0.61
▸ MAOA P21397 2/20 0.58
▸ MAPT P10636 4/20 0.56
▸ TEAD4 Q15561 1/20 0.56
▸ MAOB P27338 1/20 0.56
▸ NPC1 O15118 2/20 0.55
▸ RAB9A P51151 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ MITF O75030 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ GFER P55789 1/20 0.54
▸ KMT2A Q03164 1/20 0.54

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
SCHEMBL22109518 0.93 TDP1 (0.61) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL4017711 0.93 ALDH1A1 (0.67) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL4025998 0.93 ALDH1A1 (0.67) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL9784265 0.92 TDP1 (0.64) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL3482694 0.92 TDP1 (0.64) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL4019583 0.91 TDP1 (0.64) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL4018569 0.91 TDP1 (0.64) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL4021546 0.91 TDP1 (0.64) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL4021219 0.91 TDP1 (0.64) ALDH1A1TDP1TSHRCYP3A4LTA4H
SCHEMBL4016536 0.91 TDP1 (0.64) ALDH1A1TDP1TSHRCYP3A4LTA4H

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9459494-B2 Liquid crystal aligning agent and liquid crystal display device employing it NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-10-04 — — US disclosed
US-20140023798-A1 LIQUID CRYSTAL ALIGNING AGENT AND LIQUID CRYSTAL DISPLAY DEVICE EMPLOYING IT NISSAN CHEMICAL INDUSTRIES LIMITED (JP) 2014-01-23 — — US disclosed
US-20090220707-A1 LIQUID CRYSTAL ALIGNING AGENT AND LIQUID CRYSTAL DISPLAY DEVICE EMPLOYING IT NISSAN CHEMICAL INDUSTRIES LIMITED (JP) 2009-09-03 — — US disclosed
US-20060142538-A1 Liquid crystal orientating agent and liquid crystal display element using it NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2006-06-29 — — US disclosed
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