SCHEMBL6060118

SCHEMBL6060118

C=CCCc1ccc2cc(-c3ccc(-c4ccc(OC(F)F)cc4)cc3)ccc2c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 2/20 0.42
DAO P14920 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
HRH3 Q9Y5N1 7/20 0.35
PTGER4 P35408 1/20 0.34
DAGLA Q9Y4D2 1/20 0.33
CYP17A1 P05093 1/20 0.33
PLA2G4A P47712 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 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
SCHEMBL3966824 1.00 DRD1 (0.42) DRD1DAOFFAR4HRH3PTGER4
SCHEMBL3167749 0.89 DAO (0.34) DRD1DAOFFAR4ALDH1A1GAA
SCHEMBL3161071 0.89 PPARG (0.33) DRD1DAOFFAR4DAGLAPPARG
SCHEMBL3153765 0.86 FFAR4 (0.33) DRD1FFAR4HRH3
SCHEMBL3172954 0.86 CYP17A1 (0.34) DRD1FFAR4HRH3CYP17A1LMNA
SCHEMBL3173193 0.84 DRD1 (0.35) DRD1DAODAGLAPLA2G4A
SCHEMBL3168450 0.84 FFAR4 (0.34) FFAR4CYP17A1LMNAPPARA
SCHEMBL6059895 0.84 FFAR4 (0.34) FFAR4
SCHEMBL3162865 0.84 DRD1 (0.34) DRD1DAODAGLA
SCHEMBL3167430 0.83 HRH3 (0.42) FFAR4HRH3CYP17A1

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-1452514-A1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-09-01 EP claimed
CN-1291958-C Naphthacridine derivative and liquid crystal composite containing it DAINIPPON INK CHEMICAL IND CO (JP) 2006-12-27 CN disclosed
US-7145047-B2 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-12-05 US disclosed
EP-1452514-A1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-09-01 EP disclosed
US-20030136944-A1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-07-24 US disclosed
EP-1273562-A1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-01-08 EP disclosed
US-6468607-B1 MISCIBILITY, LARGE BIREFRINGENCE INDEX, NO STRONGLY POLAR GROUP IN ITS MOLECULE AND THUS CAN ALSO BE USED FOR ACTIVE MATRIX DRIVING, WIDE TEMPERATURE RANGE AND REQUIRES A HIGH SPEED RESPONSE AND A LOW VOLTAGE DRIVING DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-10-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030136944-A1 Naphthalene derivative and liquid crystal composition comprising the same NLK, NOTCH1, NOTCH4 DRD1 994/4885DAO 3841/4885FFAR4 3795/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.