SCHEMBL7152607

SCHEMBL7152607

Nc1cccc(P(=O)(c2ccc(C(F)(F)F)cc2)c2cccc(N)c2)c1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 7/20 0.52
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
KIF11 P52732 5/20 0.44
HDAC2 Q92769 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
MMP2 P08253 1/20 0.36

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
SCHEMBL29617169 1.00 PTGS1 (0.52) PTGS1TSHRMAPK1KIF11HDAC2
SCHEMBL11991723 0.88 KIF11 (0.43) PTGS1TSHRKIF11PGK1PGK2
SCHEMBL3310136 0.87 TSHR (0.52) PTGS1TSHRMAPK1KIF11PGK1
SCHEMBL30645311 0.87 TSHR (0.52) PTGS1TSHRMAPK1KIF11PGK1
SCHEMBL30471399 0.82 CYP3A4 (0.52) TSHRMAPK1CA12CA1
SCHEMBL9688354 0.82 CYP3A4 (0.52) TSHRMAPK1CA12CA1
SCHEMBL4323677 0.81 CYP3A4 (0.39) PTGS1TSHRMAPK1CA12CA1
SCHEMBL19472449 0.80 MAPK1 (0.45) PTGS1TSHRMAPK1PGK1PGK2
SCHEMBL11991130 0.80 PTPN5 (0.44) TSHRMAPK1KIF11
SCHEMBL9927331 0.80 DHODH (0.47) KIF11

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
CN-117343318-A Fluorine-containing polyamide and preparation method thereof 宁波斯乃隆材料科技有限公司 2024-01-05 CN claimed
CN-110669336-B Modified fluorine-containing polyimide resin composition and preparation method thereof 中山市鸿盛新材料有限公司 2022-06-17 CN claimed
CN-110669336-A Modified fluorine-containing polyimide resin composition and preparation method thereof 中山市鸿盛新材料有限公司 2020-01-10 CN claimed
US-20020095057-A1 Triarylphosphine oxide derivatives containing fluorine substituent and preparing method thereof KWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2002-07-18 US claimed
CN-117343318-A Fluorine-containing polyamide and preparation method thereof 宁波斯乃隆材料科技有限公司 2024-01-05 CN disclosed
CN-116848177-A Polyimide with low dielectric loss 索尔维特殊聚合物意大利有限公司 2023-10-03 CN disclosed
CN-110669336-B Modified fluorine-containing polyimide resin composition and preparation method thereof 中山市鸿盛新材料有限公司 2022-06-17 CN disclosed
CN-110669336-A Modified fluorine-containing polyimide resin composition and preparation method thereof 中山市鸿盛新材料有限公司 2020-01-10 CN disclosed
US-6531633-B2 Grignard reaction of bromobenzene substituted with fluoroalkyl group and diphenylphosphinic chloride in an organic solvent and magnesium, followed by nitration in sulfuric and nitric acids and hydrogenation in presence of palladium KWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2003-03-11 US disclosed
US-20020095057-A1 Triarylphosphine oxide derivatives containing fluorine substituent and preparing method thereof KWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2002-07-18 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-20020095057-A1 Triarylphosphine oxide derivatives containing fluorine substituent and preparing method thereof PFAS, PTK2, PARP1 PTGS1 4466/4885TSHR 1457/4885MAPK1 1810/4885

“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.