SCHEMBL17616210

SCHEMBL17616210

CCOc1ccc(C2CCC(C(O)CC)CC2)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM1A O60341 2/20 0.33
▸ CNR2 P34972 1/20 0.32
▸ ACACB O00763 2/20 0.31
▸ FPR2 P25090 4/20 0.31
▸ EGFR P00533 1/20 0.31
▸ LCK P06239 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ALOX5AP P20292 1/20 0.30
▸ FEN1 P39748 1/20 0.30
▸ PTGDR2 Q9Y5Y4 1/20 0.30
▸ APOBEC3G Q9HC16 1/20 0.30

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
SCHEMBL19901966 0.91 IDO1 (0.35) IDO1KMT2AACACBFPR2ALOX5AP
SCHEMBL12821099 0.88 ACACB (0.35) IDO1KDM1AACACBFPR2EGFR
SCHEMBL14922531 0.85 KDM1A (0.41) KDM1AFPR2LMNAHTTPTGDR2
SCHEMBL12823809 0.83 CNR2 (0.38) CNR2ALOX5APFEN1
SCHEMBL10303398 0.82 TP53 (0.34) KMT2AKDM1AACACBFPR2LMNA
SCHEMBL12223403 0.82 TP53 (0.34) KMT2AKDM1AACACBFPR2LMNA
SCHEMBL11940774 0.81 MAPT (0.40) KDM1AFPR2LMNAHTTPTGDR2
SCHEMBL12822791 0.81 CNR2 (0.40) CNR2ALOX5APFEN1
SCHEMBL12823527 0.81 CNR2 (0.40) CNR2ALOX5APFEN1
SCHEMBL1242545 0.81 KDM1A (0.33) IDO1KMT2AKDM1AACACBALOX5AP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9902905-B2 Liquid crystal composition and liquid crystal display including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-27 — — US disclosed
US-9902905-B2 Liquid crystal composition and liquid crystal display including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-27 — — US disclosed
US-9580652-B2 Liquid crystal compound, liquid crystal composition including the same and liquid crystal display including the liquid crystal composition SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 — — US disclosed
US-9580652-B2 Liquid crystal compound, liquid crystal composition including the same and liquid crystal display including the liquid crystal composition SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 — — US disclosed
US-20160362604-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-15 — — US disclosed
US-20160362604-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-15 — — US disclosed
US-20160083653-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME AND LIQUID CRYSTAL DISPLAY INCLUDING THE LIQUID CRYSTAL COMPOSITION SAMSUNG DISPLAY CO., LTD. (KR) 2016-03-24 — — US disclosed
US-20160083653-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME AND LIQUID CRYSTAL DISPLAY INCLUDING THE LIQUID CRYSTAL COMPOSITION SAMSUNG DISPLAY CO., LTD. (KR) 2016-03-24 — — 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-20160362604-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY INCLUDING THE SAME LEF1, CCR3, AFF1 IDO1 3121/4885KMT2A 2882/4885KDM1A 2653/4885

“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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