SCHEMBL25444305

SCHEMBL25444305

CCCCc1cccc(CCc2cc3cc4c(cc3s2)sc2cc3sc(CCc5cccc(CCCC)c5)cc3cc24)c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.40
▸ CASP3 P42574 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP6 Q9GZR1 1/20 0.35
▸ LPL P06858 3/20 0.35
▸ LIPG Q9Y5X9 3/20 0.35
▸ SPHK2 Q9NRA0 3/20 0.34
▸ SPHK1 Q9NYA1 2/20 0.34
▸ PCSK9 Q8NBP7 1/20 0.33
▸ SKP2 Q13309 1/20 0.32
▸ NOS3 P29474 1/20 0.32
▸ NOS1 P29475 1/20 0.32

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
SCHEMBL25444316 0.85 CA2 (0.36) CASP3SENP8SENP7SENP6SKP2
SCHEMBL20464571 0.84 LMNA (0.34) —
SCHEMBL25444312 0.82 CA2 (0.34) CASP3SENP8SENP7SENP6SKP2
SCHEMBL24863749 0.81 DAO (0.37) NOS1
SCHEMBL18371551 0.81 LMNA (0.33) —
SCHEMBL18998903 0.79 MAPT (0.32) —
SCHEMBL18382248 0.79 ESR1 (0.40) —
SCHEMBL18434198 0.78 MAPT (0.34) —
SCHEMBL18998904 0.78 MAPT (0.34) —
SCHEMBL18371544 0.78 MAPT (0.34) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230142592-A1 AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR LAYER AND ORGANIC THIN FILM TRANSISTOR TOSOH CORPORATION (JP) 2023-05-11 — — 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-20230142592-A1 AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR LAYER AND ORGANIC THIN FILM TRANSISTOR CHRM1, CHRM2, ACVRL1 XIAP 3756/4885CASP3 3396/4885SENP8 4448/4885

“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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