SCHEMBL18121548

SCHEMBL18121548

COc1ccc(C(=O)Oc2ccc(-c3ccc(O)c(O)c3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ KMT2A Q03164 4/20 0.51
▸ MAPT P10636 1/20 0.51
▸ GFER P55789 1/20 0.51
▸ PRSS1 P07477 1/20 0.51
▸ ACR P10323 1/20 0.51
▸ CA1 P00915 2/20 0.50
▸ CA2 P00918 2/20 0.50
▸ ESR1 P03372 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ EGFR P00533 1/20 0.48
▸ ERN1 O75460 1/20 0.48
▸ HDAC4 P56524 1/20 0.48
▸ HDAC2 Q92769 1/20 0.48
▸ HDAC8 Q9BY41 1/20 0.48
▸ CA12 O43570 1/20 0.47

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
SCHEMBL15948378 0.89 CA1 (0.61) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL18121555 0.89 CA1 (0.61) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL19021126 0.87 CA1 (0.56) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL18329185 0.87 CA1 (0.62) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL13859676 0.87 LMNA (0.68) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL16604902 0.87 LMNA (0.68) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL14817293 0.87 LMNA (0.68) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL8983994 0.84 ESR2 (0.66) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL14877890 0.84 ESR2 (0.66) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL22109034 0.84 ESR2 (0.66) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170174992-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, COMPOSITION, LIQUID CRYSTAL POLYMERIZATION FILM-KIND THEREOF AND USE THEREOF JNC CORPORATION (JP) 2017-06-22 — — US disclosed
US-9540567-B2 Polymerizable liquid crystal composition and optically anisotropic body JNC CORPORATION (JP) 2017-01-10 — — US disclosed
US-20160369166-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND OPTICAL ANISOTROPICAL BODY THEREOF JNC CORPORATION (JP) 2016-12-22 — — US disclosed
US-20160289562-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND OPTICALLY ANISOTROPIC BODY JNC CORPORATION (JP) 2016-10-06 — — 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-20170174992-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, COMPOSITION, LIQUID CRYSTAL POLYMERIZATION FILM-KIND THEREOF AND USE THEREOF RCC1, CHRM1, PFN1 LMNA 432/4885CYP1A2 703/4885CYP2C9 2312/4885

“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.

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