SCHEMBL3149232

SCHEMBL3149232

Cc1cccc(C)c1OCc1cc(OC(F)(F)C(F)(F)F)ccc1CCl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 5/20 0.36
ATM Q13315 2/20 0.33
AR P10275 1/20 0.32
FFAR4 Q5NUL3 3/20 0.31
FFAR1 O14842 2/20 0.31
SCN4A P35499 3/20 0.31
SCN5A Q14524 3/20 0.31
CYP3A4 P08684 2/20 0.31
KCNH2 Q12809 2/20 0.31
CACNA1C Q13936 2/20 0.31
LMNA P02545 2/20 0.31
SCN1A P35498 2/20 0.31
SCN9A Q15858 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
KCNK3 O14649 1/20 0.31
CACNA1F O60840 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
SCHEMBL3155529 0.90 SCN8A (0.45) SCN8AATMARFFAR4SCN5A
SCHEMBL2939836 0.84 SCN8A (0.37) SCN8AATMARFFAR4FFAR1
SCHEMBL1200538 0.81 SCN8A (0.37) SCN8AATMARFFAR4FFAR1
SCHEMBL3157440 0.79 MAPT (0.36) SCN8AATMARFFAR4FFAR1
SCHEMBL3149262 0.78 ALDH1A1 (0.37) SCN8AATMSCN4ASCN5ACYP3A4
SCHEMBL3147078 0.78 FFAR1 (0.39) FFAR4FFAR1SCN4AALDH1A1POLB
SCHEMBL3150527 0.77 LMNA (0.44) ATMCYP3A4LMNAMEN1KMT2A
SCHEMBL3155503 0.77 CA12 (0.35) SCN4ALMNACYP2D6MEN1KMT2A
SCHEMBL1200371 0.76 AR (0.34) SCN8AATMARFFAR1SCN9A
SCHEMBL3144508 0.76 ALDH1A1 (0.33) SCN8AATMFFAR1SCN4ASCN5A

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
EP-2154123-B1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2013-10-23 EP disclosed
US-7851659-B2 Method for producing benzaldehyde compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-14 US disclosed
US-20100234645-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 US disclosed
EP-2154123-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-02-17 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 (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-20100234645-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND NQO1, NQO2, NDUFC2 SCN8A 274/4885ATM 1758/4885AR 4380/4885

“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.