SCHEMBL9130561

SCHEMBL9130561

O=C(C1=C(N2CCCC2)CCC1)c1ccccc1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ L3MBTL3 Q96JM7 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ KMT2A Q03164 4/20 0.40
▸ GAA P10253 3/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ ALOX12 P18054 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ STAT1 P42224 1/20 0.36

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
SCHEMBL9130178 0.75 MAPT (0.50) ALDH1A1LMNARAB9AKMT2AGAA
SCHEMBL9130763 0.70 MAPK13 (0.50) LMNANPC1RAB9AKMT2AGAA
SCHEMBL29470997 0.69 PRNP (0.53) L3MBTL1ALDH1A1NPC1RAB9AKMT2A
SCHEMBL1681866 0.69 PRNP (0.53) L3MBTL1ALDH1A1NPC1RAB9AKMT2A
SCHEMBL4163170 0.67 L3MBTL3 (0.71) L3MBTL1L3MBTL3ALDH1A1LMNANPC1
SCHEMBL3844423 0.67 PRNP (0.57) L3MBTL1ALDH1A1NPC1RAB9AKMT2A
SCHEMBL9679485 0.67 PRNP (0.57) L3MBTL1ALDH1A1NPC1RAB9AKMT2A
SCHEMBL3455048 0.66 L3MBTL3 (0.69) L3MBTL1L3MBTL3ALDH1A1LMNANPC1
SCHEMBL28086833 0.63 NPC1 (0.70) L3MBTL1ALDH1A1LMNANPC1RAB9A
SCHEMBL11722321 0.63 ALDH1A1 (0.77) L3MBTL1L3MBTL3ALDH1A1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5439916-A Antiallergens,-inflammatory and -ulcer agents; hypotensive agents; immunosuppressants; skin disorders SCHERING CORPORATION (US) 1995-08-08 — — US disclosed
US-5126352-A Antiallergy, antiinflammatory, antiulcer, hypotensive, antibody inhibitors SCHERING CORPORATION (US) 1992-06-30 — — US disclosed
US-5116840-A Antiulcer, antiinflammatory, hypotensive, immunosuppressants SCHERING CORPORATION (US) 1992-05-26 — — US disclosed
EP-0229823-B1 POLYCYCLIC QUINOLINE, NAPHTHYRIDINE AND PYRAZINOPYRIDINE DERIVATIVES SCHERING CORPORATION (US) 1991-09-25 — — EP disclosed
US-4988705-A Antiallergens and -inflammatory agents; hypotensive agents immunological suppression; hyperproliferative skin disorders such as psoriasis SCHERING CORPORATION (US) 1991-01-29 — — US disclosed
US-4810708-A ANTIALLERGY, IMMUNOSUPPRESSIVE SCHERING CORPORATION (US) 1989-03-07 — — US disclosed
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