SCHEMBL7258705

SCHEMBL7258705

NNc1ccccc1CCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ TDP1 Q9NUW8 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ TRPV1 Q8NER1 2/20 0.40
▸ HPGD P15428 1/20 0.37
▸ CA12 O43570 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA6 P23280 1/20 0.36
▸ CA5A P35218 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA5B Q9Y2D0 1/20 0.36
▸ SIGMAR1 Q99720 2/20 0.35
▸ GRIN2D O15399 1/20 0.35
▸ GRIN3B O60391 1/20 0.35
▸ GRIN1 Q05586 1/20 0.35

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
SCHEMBL6934824 0.84 SLC16A3 (0.41) ALDH1A1GAAMAPTTDP1POLB
SCHEMBL24728413 0.82 ALDH1A1 (0.52) ALDH1A1GAAMAPTTDP1POLB
SCHEMBL30105270 0.82 GAA (0.47) ALDH1A1GAAMAPTPOLBL3MBTL1
SCHEMBL7558964 0.82 ALDH1A1 (0.35) ALDH1A1GAAMAPTTDP1POLB
SCHEMBL2487614 0.80 TRPV1 (0.40) ALDH1A1GAAMAPTTDP1L3MBTL1
SCHEMBL4521444 0.80 L3MBTL1 (0.52) ALDH1A1GAAMAPTPOLBL3MBTL1
SCHEMBL21930796 0.80 TDP1 (0.41) ALDH1A1GAAMAPTTDP1TRPV1
SCHEMBL932125 0.78 TDP1 (0.40) ALDH1A1MAPTTDP1POLBL3MBTL1
SCHEMBL28986869 0.78 ALDH1A1 (0.41) ALDH1A1GAAMAPTTDP1POLB
SCHEMBL7438728 0.78 ALDH1A1 (0.46) ALDH1A1GAAMAPTTDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614898-B1 INDOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL USE THEREOF TORAY INDUSTRIES (JP) 2003-05-07 — — EP disclosed
US-6291470-B1 DELTA-OPIOID ANTAGONIST HAVING HIGH SELECTIVITY AND ACTIVITY, THAT EXHIBITS IMMUNOSUPPRESSIVE ACTION, ANTIALLERGIC ACTION, ANTI-INFLAMMATORY ACTION AND BRAIN CELL-PROTECTING ACTION TORAY INDUSTRIES, INC. (JP) 2001-09-18 — — US disclosed
US-6087369-A AN IMMUNOSUPPRESSIVE AGENT, ANTIALLERGIC AGENT, ANTI-INFLAMMATORY AGENT AND BRAIN CELL-PROTECTING AGENT TORAY INDUSTRIES, LTD. (JP) 2000-07-11 — — US disclosed
CN-1043766-C Indole derivative and preparation and pharmaceutical using of same TORAY INDUSTRIES (JP) 1999-06-23 — — CN disclosed
US-5852030-A Indole derivatives, process for producing the same and medicinal uses of the same TORAY INDUSTRIES, INC. (JP) 1998-12-22 — — US disclosed
CN-1092425-A Indole derivatives, its manufacture method and medicinal use thereof TORAY INDUSTRIES (JP) 1994-09-21 — — CN disclosed
EP-0614898-A1 INDOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1994-09-14 — — EP disclosed
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