SCHEMBL8963314

SCHEMBL8963314

Cc1cc(C)c(P)cc1C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL12955081 0.93 ESR1 (0.33) CYP3A4TSHRMAPK1ESR1ALDH1A1
SCHEMBL19311682 0.76 GPR3 (0.32) —
SCHEMBL25606316 0.76 CYP3A4 (0.60) CYP3A4TSHRMAPK1NPC1RAB9A
SCHEMBL10052130 0.76 CYP3A4 (0.60) CYP3A4TSHRMAPK1ESR1ALDH1A1
SCHEMBL20220230 0.76 GPR3 (0.32) —
SCHEMBL39444 0.76 TSHR (0.57) CYP3A4TSHRMAPK1NPC1RAB9A
SCHEMBL8109982 0.76 TSHR (0.57) CYP3A4TSHRMAPK1NPC1RAB9A
SCHEMBL31498545 0.71 TSHR (0.53) CYP3A4TSHRMAPK1NPC1RAB9A
SCHEMBL30336851 0.71 TSHR (0.53) CYP3A4TSHRMAPK1NPC1RAB9A
SCHEMBL5180999 0.71 TSHR (0.53) CYP3A4TSHRMAPK1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312481-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF ARBUTUS BIOPHARMA CORP (CA) 2023-10-05 — — US disclosed
CN-106660953-A High heat monomers and methods of use thereof 沙特基础工业全球技术有限公司 2017-05-10 — — CN disclosed
CN-106536589-A High heat monomer and method of use thereof 沙特基础工业全球技术有限公司 2017-03-22 — — CN disclosed
US-8119764-B2 Medical devices made of a polymer material SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2012-02-21 — — US disclosed
US-20090082539-A1 Medical devices made of a polymer material SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2009-03-26 — — US disclosed
US-5481049-A REACTING CONJUGATED DIENE AND WATER IN PRESENCE OF CARBON DIOXIDE, USING PALLADIUM COMPOUND AND A FREE PHOSPHINE AS CATALYSTS MITSUBISHI CHEMICAL CORPORATION (JP) 1996-01-02 — — 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-20230312481-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF NSD3, PML, NSD1 CYP3A4 1684/4885TSHR 3398/4885MAPK1 2828/4885

“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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