SCHEMBL8048528

SCHEMBL8048528

CCc1ccc(C(=O)O)c(-c2ccc(C#N)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.50
LTB4R2 Q9NPC1 1/20 0.49
BRS3 P32247 1/20 0.45
SLC22A12 Q96S37 6/20 0.43
XDH P47989 3/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GRIA2 P42262 1/20 0.42
GRIA4 P48058 1/20 0.42
KDM1A O60341 1/20 0.42
MMP12 P39900 1/20 0.41
MMP13 P45452 1/20 0.41
PTGER4 P35408 1/20 0.41
AR P10275 1/20 0.41
MAP4K4 O95819 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
SCHEMBL7512343 0.89 LTB4R2 (0.53) LTB4R2BRS3SLC22A12XDHKDM1A
SCHEMBL11768545 0.87 LTB4R2 (0.53) LTB4R2BRS3SLC22A12
SCHEMBL20594609 0.86 RAB9A (0.54) LTB4R2SLC22A12XDHRAB9ASMN1; SMN2
SCHEMBL6267448 0.85 TSHR (0.58) LTB4R2BRS3
SCHEMBL6269842 0.84 TSHR (0.60) LTB4R2
SCHEMBL3192071 0.83 TSHR (0.63) LTB4R2
SCHEMBL29038974 0.83 SLC22A12 (0.54) SLC22A12XDHMAP4K4
SCHEMBL7213550 0.82 ALOX5 (0.43) LTB4R2BRS3SLC22A12XDHMMP12
SCHEMBL10909137 0.82 PTPN1 (0.53) LTB4R2RAB9ASMN1; SMN2
Benzoic Acid SCHEMBL11341174 0.81 LTB4R2 (0.53) LTB4R2BRS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115301082-B Nanoscale microporous filter membrane, preparation method and application thereof 上海先认新材料合伙企业(有限合伙) 2024-01-16 CN disclosed
CN-115301082-A Nanoscale microporous filter membrane, preparation method and application thereof 上海先认新材料合伙企业(有限合伙) 2022-11-08 CN disclosed
EP-0805134-B1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORP (JP) 2000-08-30 EP disclosed
US-6086964-A Liquid crystalline compound having dienyl moiety and liquid crystal composition CHISSO CORPORATION (JP) 2000-07-11 US disclosed
EP-0733692-B1 Liquid crystalline compound, liquid crystal composition containing the same, and display device CHISSO CORP (JP) 2000-06-14 EP disclosed
EP-0700982-B1 A liquid crystal composition and a liquid crystal display element using the same CHISSO CORP (JP) 2000-04-26 EP disclosed
US-6001275-A LIQUID CRYSTALLINE COMPOUND WHICH HAS A LARGE RATIO OF ELASTIC CONSTANTS, HAS A LOW VISCOSITY, EXCELLENT MISCIBILITY WITH OTHER LIQUID CRYSTALLINE COMPOUND, CHEMICALLY STABLE; HAVING AN UNCONJUGATED ALKADIENYL GROUP AT A SIDE CHAIN. CHISSO CORPORATION (JP) 1999-12-14 US disclosed
US-5833879-A LOW TEMPERATURE MISCIBILITY AND COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS; DISPLAYS CONTAINING MIXTURES OF AT LEAST TWO COMPOUNDS, PHYSICAL PROPERTIES CHISSO CORPORATION (JP) 1998-11-10 US disclosed
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
EP-0805134-A1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-11-05 EP disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US disclosed
EP-0700982-A1 A liquid crystal composition and a liquid crystal display element using the same Chisso Corporation (JP) 1996-03-13 EP disclosed