SCHEMBL9685526

SCHEMBL9685526

O=P(Cl)(Cl)OCCCCBr

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LPAR3 Q9UBY5 3/20 0.32
LPAR1 Q92633 2/20 0.32
LPAR2 Q9HBW0 2/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL11292820 0.98 TP53 (0.39) TP53TDP1LPAR3LPAR1LPAR2
SCHEMBL9530571 0.98 TP53 (0.39) TP53TDP1LPAR3LPAR1LPAR2
SCHEMBL10597981 0.98 TP53 (0.39) TP53TDP1LPAR3LPAR1LPAR2
SCHEMBL8674267 0.98 TP53 (0.39) TP53TDP1LPAR3LPAR1LPAR2
SCHEMBL10708258 0.92
SCHEMBL10316593 0.87 TP53 (0.50) TP53TDP1LPAR3LPAR1LPAR2
SCHEMBL11665213 0.83 LPAR3 (0.35) LPAR3LPAR1LPAR2CYP3A4
SCHEMBL10598471 0.83 LPAR3 (0.35) LPAR3LPAR1LPAR2CYP3A4
SCHEMBL93503 0.81
SCHEMBL10598475 0.79 LPAR3 (0.42) LPAR3LPAR1LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145844-A Enzyme inhibitors, antiinflammatory agents, analgesics HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-09-08 US disclosed
US-5036152-A Antiinflammatory HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-07-30 US disclosed
US-5030733-A Analgesics, antiinflammatory agents, phospholipase inhibitor HOECHST-ROUSSEL PHARMACETICALS INCORPORATED (US) 1991-07-09 US disclosed
US-4891363-A PLATELET ACTIVATING FACTOR ANTAGONISTS SANKYO COMPANY LIMITED (JP) 1990-01-02 US disclosed
US-4888328-A Alkoxycarbonylalkylphospholipids and alkylaminocarbonylalkylphospholipids HOESCHST-ROUSSEL INCORPORATED (US) 1989-12-19 US disclosed
EP-0332129-A2 Alkoxy- and alkylamino-carbonylalkylphospholipids, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-09-13 EP disclosed
EP-0210804-B1 PHOSPHATE ESTER DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANKYO COMPANY LIMITED (JP) 1989-05-10 EP disclosed
EP-0184905-B1 2-ACETOACETYLGLYCEROL DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1989-03-01 EP disclosed
US-4710579-A ANTITUMOR AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-12-01 US disclosed
EP-0210804-A1 Phosphate ester derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1987-02-04 EP disclosed
EP-0107120-B1 SUBSTITUTED AMINOALCANOL PHOSPHOLIPIDS AND PROCESS FOR THEIR PREPARATION A. Nattermann & Cie. GmbH (DE) 1986-10-29 EP disclosed
EP-0121088-B1 NEW O-ACYL-ALKANEDIOL-PHOSPHOLIPIDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1986-10-01 EP disclosed
US-4610979-A O-acyl-alkanediol-phospholipids and processes for the treatment of asthma A. NATTERMANN & CIE GMBH (DE) 1986-09-09 US disclosed
EP-0184905-A1 2-Acetoacetylglycerol derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1986-06-18 EP disclosed
US-4565659-A Substituted aminoalkanol phospholipids A. NATTERMANN & CIE GMBH (DE) 1986-01-21 US disclosed
EP-0121088-A1 New o-acyl-alkanediol-phospholipids, processes for their preparation and pharmaceutical preparations containing them A. Nattermann & Cie. GmbH (DE) 1984-10-10 EP disclosed
EP-0107120-A1 Substituted aminoalcanol phospholipids and process for their preparation A. Nattermann & Cie. GmbH (DE) 1984-05-02 EP disclosed