SCHEMBL8394139

SCHEMBL8394139

CCCCN(CCCC(=O)OCC)c1cccc(C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ TP53 P04637 2/20 0.50
▸ GPX4 P36969 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ PAX8 Q06710 1/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ ALOX5 P09917 1/20 0.44
▸ MAPT P10636 2/20 0.42
▸ LTB4R2 Q9NPC1 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HPGD P15428 1/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ CYP4F2 P78329 1/20 0.40

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
SCHEMBL16212493 0.96 SMN1; SMN2 (0.50) ALDH1A1NPC1TP53GPX4RAB9A
SCHEMBL8391475 0.95 ALDH1A1 (0.50) ALDH1A1NPC1TP53GPX4RAB9A
SCHEMBL1252550 0.91 MAPT (0.50) ALDH1A1NPC1TP53GPX4RAB9A
SCHEMBL8393183 0.90 ALDH1A1 (0.47) ALDH1A1NPC1TP53GPX4RAB9A
SCHEMBL9654341 0.88 SMN1; SMN2 (0.52) ALDH1A1NPC1TP53GPX4RAB9A
SCHEMBL18700509 0.85 LTB4R2 (0.48) ALDH1A1SMN1; SMN2ALOX5LTB4R2HPGD
SCHEMBL11671513 0.84 ALDH1A1 (0.44) ALDH1A1NPC1TP53GPX4RAB9A
SCHEMBL5284253 0.83 ALDH1A1 (0.50) ALDH1A1NPC1TP53GPX4RAB9A
SCHEMBL11742038 0.83 SMN1; SMN2 (0.48) ALDH1A1NPC1TP53GPX4RAB9A
SCHEMBL11506912 0.82 SMN1; SMN2 (0.50) ALDH1A1NPC1TP53GPX4RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE36357-E IMPROVED BRIGHTNESS OF SHADE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1999-10-26 — — US disclosed
EP-0216483-B2 Thermal transfer printing ZENECA LTD (GB) 1995-11-02 — — EP disclosed
EP-0399673-B1 Thermal transfer printing ZENECA LTD (GB) 1994-09-07 — — EP disclosed
EP-0366261-B1 Thermal transfer printing ZENECA LTD (GB) 1993-12-15 — — EP disclosed
EP-0351968-B1 THERMAL TRANSFER PRINTING IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-04-28 — — EP disclosed
US-5091360-A Using black dye mixture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-25 — — US disclosed
US-5070069-A ANTHRAQUINONE AND DISAZO DYE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-12-03 — — US disclosed
EP-0218397-B1 THERMAL TRANSFER PRINTING IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-11-06 — — EP disclosed
US-4977135-A Substrate having a coating comprising a binder and an anthraquinone dye; diffusion transfer inks; cyan shades of high colorfastness IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-12-11 — — US disclosed
EP-0399673-A1 Thermal transfer printing IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-11-28 — — EP disclosed
EP-0366261-A1 Thermal transfer printing ZENECA LIMITED (GB) 1990-05-02 — — EP disclosed
EP-0216483-B1 THERMAL TRANSFER PRINTING ZENECA LIMITED (GB) 1990-04-11 — — EP disclosed
US-4908435-A Aromatic disazo compounds having strong infra-red absorption IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-03-13 — — US disclosed
EP-0351968-A2 Thermal transfer printing IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-01-24 — — EP disclosed
US-4764178-A Thermal transfer printing: hetero-aromatic azo dye IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-08-16 — — US disclosed
US-4743581-A AZO DYES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-05-10 — — US disclosed
EP-0218397-A2 Thermal transfer printing IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-04-15 — — EP disclosed
EP-0216483-A1 Thermal transfer printing ZENECA LIMITED (GB) 1987-04-01 — — EP disclosed
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