SCHEMBL10000690

SCHEMBL10000690

CCCCCCC(C)Oc1ccc(-c2ccc(-c3ccc(OCc4ccccc4)cc3)c(F)c2F)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.49
GSTP1 P09211 2/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
BCHE P06276 3/20 0.39
PPARA Q07869 2/20 0.39
AR P10275 1/20 0.39
GPR88 Q9GZN0 1/20 0.39
MCL1 Q07820 1/20 0.38
LTA4H P09960 1/20 0.38
EPHX2 P34913 1/20 0.38
PPARG P37231 1/20 0.38
PLA2G10 O15496 1/20 0.38
PLA2G2A P14555 1/20 0.38

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
SCHEMBL8924266 0.88 CTRC (0.59) CTRCLMNAL3MBTL1BCHEPPARA
SCHEMBL9799651 0.88 CTRC (0.59) CTRCLMNAL3MBTL1BCHEPPARA
SCHEMBL7775204 0.88 CTRC (0.59) CTRCLMNAL3MBTL1BCHEPPARA
SCHEMBL13029242 0.86 NR5A1 (0.43) L3MBTL1LTA4HPLA2G2A
Monobenzone SCHEMBL10867013 0.83 CTRC (0.57) CTRCLMNAL3MBTL1BCHEPPARA
SCHEMBL10000689 0.83 NR5A1 (0.43) LMNAL3MBTL1GPR88LTA4H
SCHEMBL13068574 0.82 APP (0.37) GPR88
SCHEMBL10000688 0.82 GPR88 (0.36) PPARAGPR88
SCHEMBL9405922 0.81 GSTP1 (0.46) GSTP1ARLTA4HEPHX2PLA2G10
SCHEMBL10624624 0.80 NR5A1 (0.48) CTRCLTA4H

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-8101095-B2 Antiferroelectric orthoconic liquid crystalline material with long pitch and the method of its preparation WOJSKOWA AKADEMIA TECHNICZNA IM. JAROSLAWA DABROWSKIEGO (PL) 2012-01-24 US disclosed
US-20100258765-A1 ANTIFERROELECTRIC ORTHOCONIC LIQUID CRYSTALLINE MATERIAL WITH LONG PITCH AND THE METHOD OF ITS PREPARATION WOJSKOWA AKADEMIA TECHNICZNA IM. JAROSLAWA DABROWSKIEGO (PL) 2010-10-14 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-20100258765-A1 ANTIFERROELECTRIC ORTHOCONIC LIQUID CRYSTALLINE MATERIAL WITH LONG PITCH AND THE METHOD OF ITS PREPARATION CRY2, PAX2, CXXC5 CTRC 858/4885GSTP1 3654/4885LMNA 936/4885

“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.