SCHEMBL20802476

SCHEMBL20802476

Cc1ccc2c(Cl)c(C)c(F)cc2c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.39
CYP2A6 P11509 4/20 0.39
LMNA P02545 3/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.34
ESR1 P03372 4/20 0.34
ESR2 Q92731 4/20 0.34
PTGES O14684 1/20 0.34
BCL2L1 Q07817 1/20 0.33
MCL1 Q07820 1/20 0.33
MAOA P21397 1/20 0.33
KIF11 P52732 1/20 0.33
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL16188798 0.82 CYP1A2 (0.44) CYP1A2CYP2A6LMNAKDM4EALDH1A1
SCHEMBL14525496 0.81 CYP1A2 (0.39) CYP1A2CYP2A6LMNAKDM4EALDH1A1
SCHEMBL12227988 0.80 CYP1A2 (0.42) CYP1A2CYP2A6LMNAKDM4EALDH1A1
SCHEMBL27286459 0.78 CYP1A2 (0.46) CYP1A2CYP2A6LMNAKDM4EALDH1A1
SCHEMBL14525479 0.74 CYP1A2 (0.44) CYP1A2CYP2A6LMNAKDM4EALDH1A1
SCHEMBL20802475 0.73 CYP1A2 (0.39) CYP1A2CYP2A6LMNAKDM4EALDH1A1
SCHEMBL19153759 0.71 CYP1A2 (0.46) CYP1A2CYP2A6LMNAKDM4EALDH1A1
SCHEMBL20803062 0.71 PTPN11 (0.31) ESR1ESR2
SCHEMBL17787997 0.71 LMNA (0.50) CYP1A2CYP2A6LMNAKDM4EALDH1A1
SCHEMBL14444114 0.69 CYP1A2 (0.50) CYP1A2CYP2A6LMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10676669-B2 Compound having naphthalene ring, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2020-06-09 US disclosed
US-20190078019-A1 COMPOUND HAVING NAPHTHALENE RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2019-03-14 US disclosed
EP-3453697-A1 COMPOUND HAVING NAPHTHALENE RING, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2019-03-13 EP 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-10676669-B2 Compound having naphthalene ring, liquid crystal composition and liquid crystal display device PYM1, CXCR1, CPNE4 CYP1A2 179/4885CYP2A6 2002/4885LMNA 1099/4885

“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.