SCHEMBL10301620

SCHEMBL10301620

CCOc1ccc(C2CCC(c3ccc(CO)c(F)c3)CC2)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.42
FPR2 P25090 4/20 0.35
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
KLKB1 P03952 1/20 0.34
PDE4A P27815 2/20 0.33
TPH1 P17752 2/20 0.33
NAAA Q02083 1/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
KMT2A Q03164 1/20 0.32
PANK3 Q9H999 1/20 0.32
DHODH Q02127 1/20 0.32
CAMKK1 Q8N5S9 1/20 0.32
CAMKK2 Q96RR4 1/20 0.32
RORC P51449 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
SCHEMBL10301614 0.90 KDM1A (0.44) KDM1AFPR2KDM5AKDM4CKDM5B
SCHEMBL15381806 0.89 KDM1A (0.43) KDM1AFPR2KDM5AKDM4CKDM5B
SCHEMBL10301619 0.89 KDM1A (0.37) KDM1AFPR2KDM5AKDM4CKDM5B
SCHEMBL10301615 0.88 KDM1A (0.42) KDM1AFPR2KDM5AKDM4CKDM5B
SCHEMBL15381590 0.88 KDM1A (0.42) KDM1AFPR2KDM5AKDM4CKDM5B
SCHEMBL10301616 0.85 KDM1A (0.40) KDM1APDE4A
SCHEMBL11933464 0.84 KDM1A (0.39) KDM1AKDM5AKDM4CKDM5BTPH1
SCHEMBL10302848 0.84 KDM1A (0.48) KDM1AFPR2PDE4AMEN1KMT2A
SCHEMBL10301621 0.84 KDM1A (0.45) KDM1AFPR2PDE4ATPH1DHODH
SCHEMBL15381796 0.83 KDM1A (0.39) KDM1AFPR2KDM5AKDM4CKDM5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8216489-B2 Three-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-07-10 US disclosed
US-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-02-17 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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, L3MBTL3 KDM1A 549/4885FPR2 2267/4885KDM5A 1880/4885

“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.