SCHEMBL257919

SCHEMBL257919

Cc1ccc(Oc2ccc(C)c(F)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD4 Q15561 1/20 0.48
ALDH1A1 P00352 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.47
AR P10275 2/20 0.44
HTT P42858 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
SOS1 Q07889 1/20 0.41
ACHE P22303 2/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
MMP13 P45452 1/20 0.39
LMNA P02545 1/20 0.39
GFER P55789 1/20 0.39

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
SCHEMBL15075246 0.86 LTA4H (0.48) ALDH1A1TDP1HTTL3MBTL1SMN1; SMN2
SCHEMBL28061160 0.86 LTA4H (0.48) ALDH1A1MAPTHTTL3MBTL1KMT2A
SCHEMBL257856 0.85 SOS1 (0.55) TEAD4ALDH1A1TDP1MAPTPOLB
SCHEMBL257852 0.85 SOS1 (0.50) MAPTL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL12260917 0.84 SOS1 (0.39) TEAD4ALDH1A1TDP1MAPTPOLB
SCHEMBL18210774 0.83 TEAD4 (0.48) TEAD4ALDH1A1TDP1MAPTPOLB
SCHEMBL8234333 0.82 KDM4C (0.39) MAPTL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL27301155 0.82 ALDH1A1 (0.58) ALDH1A1TDP1MAPTARHTT
SCHEMBL9900485 0.82 SOS1 (0.38) ALDH1A1MAPTARL3MBTL1KMT2A
SCHEMBL22185238 0.81 LMNA (0.41) TEAD4ALDH1A1MAPTPOLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240072425-A1 AROMATIC ISOTHIOCYANATES MERCK PATENT GMBH (DE) 2024-02-29 US disclosed
US-11834599-B2 Aromatic isothiocyanates MERCK PATENT GMBH (DE) 2023-12-05 US disclosed
US-11795398-B2 Liquid-crystalline medium and liquid-crystal display comprising the same and compounds MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
US-20230323207-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-10-12 US disclosed
US-11739265-B2 Aromatic isothiocyanates MERCK PATENT GMBH (DE) 2023-08-29 US disclosed
WO-2020141439-A1 HETEROCYCLIC COMPOUNDS AS MUTANT IDH INHIBITORS INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2020-07-09 WO disclosed
EP-2404607-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2012-01-11 EP disclosed
EP-2399585-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 EP disclosed
EP-2399584-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 EP disclosed
EP-2073816-B1 BORONIC ACIDS AND ESTERS AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS INC (US) 2011-09-14 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 (2 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-20240072425-A1 AROMATIC ISOTHIOCYANATES TRPA1, TRPC1, CRY1 TEAD4 205/4885ALDH1A1 1864/4885TDP1 3229/4885
US-11739265-B2 Aromatic isothiocyanates TRPA1, CRY1, FOXM1 TEAD4 180/4885ALDH1A1 1554/4885TDP1 2841/4885

“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.