SCHEMBL8175477

SCHEMBL8175477

N[C@H](Cc1ccccc1)[C@H]1CC(Cc2ccccc2)=NO1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SORT1 Q99523 1/20 0.39
▸ EPHX1 P07099 1/20 0.38
▸ SLC6A2 P23975 2/20 0.36
▸ TAAR1 Q96RJ0 2/20 0.36
▸ MAOA P21397 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ CYP2A6 P11509 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ ANPEP P15144 3/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ ALPI P09923 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ XIAP P98170 1/20 0.33
▸ SLC7A5 Q01650 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ RAB9A P51151 1/20 0.33

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
SCHEMBL8178047 1.00 SORT1 (0.39) SORT1EPHX1SLC6A2TAAR1MAOA
SCHEMBL7789573 1.00 SORT1 (0.39) SORT1EPHX1SLC6A2TAAR1MAOA
SCHEMBL7797908 1.00 SORT1 (0.39) SORT1EPHX1SLC6A2TAAR1MAOA
Hydrochloric Acid SCHEMBL7796588 0.99 SORT1 (0.38) SORT1EPHX1SLC6A2TAAR1MAOA
Hydrochloric Acid SCHEMBL8175122 0.99 SORT1 (0.38) SORT1EPHX1SLC6A2TAAR1MAOA
Oxalic Acid SCHEMBL7796367 0.93 ALPI (0.39) SORT1ANPEPALPIPKMPTGS1
Oxalic Acid SCHEMBL8178368 0.93 ALPI (0.39) SORT1ANPEPALPIPKMPTGS1
SCHEMBL8174696 0.90 SORT1 (0.35) SORT1SLC6A2TAAR1MAOASLC6A4
Benzoic Acid SCHEMBL8175478 0.90 SLC1A3 (0.37) SORT1EPHX1ANPEPALPIPKM
SCHEMBL7789574 0.90 SORT1 (0.35) SORT1SLC6A2TAAR1MAOASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962692-A 2-isoxazoline derivative and process for producing the same, and process for producing related derivatives from the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-05 — — US claimed
US-6018069-A 2-isoxazoline derivative and process for producing the same and process for producing related derivatives from the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-01-25 — — US disclosed
US-5962692-A 2-isoxazoline derivative and process for producing the same, and process for producing related derivatives from the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-05 — — US disclosed
US-5750717-A 2-isoxazoline derivative and process for producing the same, and process for producing related derivatives from the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-05-12 — — US disclosed
EP-0748801-A1 2-ISOXAZOLINE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING RELATED DERIVATIVES FROM THE SAME DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-18 — — EP disclosed
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