SCHEMBL7412199

SCHEMBL7412199

O=[N+]([O-])/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 13/20 0.70
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48
VCP P55072 2/20 0.45
EGFR P00533 2/20 0.44
ABL1 P00519 1/20 0.44
ABL2 P42684 1/20 0.44

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
SCHEMBL6811553 0.84 FBP1 (0.56) FBP1MAOAMAOBVCPEGFR
SCHEMBL6811555 0.84 FBP1 (0.56) FBP1MAOAMAOBVCPEGFR
SCHEMBL30592090 0.82 FBP1 (1.00) FBP1MAOAMAOBVCP
SCHEMBL3862500 0.82 FBP1 (1.00) FBP1MAOAMAOBVCP
SCHEMBL3862508 0.82 FBP1 (1.00) FBP1MAOAMAOBVCP
SCHEMBL794128 0.81 FBP1 (1.00) FBP1MAOAMAOBVCPEGFR
SCHEMBL794129 0.81 FBP1 (1.00) FBP1MAOAMAOBVCPEGFR
SCHEMBL21064478 0.75 PTGS2 (0.58) FBP1
SCHEMBL2285894 0.74 FBP1 (0.67) FBP1VCPEGFRABL1ABL2
SCHEMBL2285892 0.74 FBP1 (0.67) FBP1VCPEGFRABL1ABL2

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
CN-113660932-B Phenyl derivatives having pendant alkyl and alkenyl extensions and pharmaceutical compositions comprising the same 景凯生物科技股份有限公司 2024-07-12 CN disclosed
US-20220153687-A1 PERIPHERAL ALKYL AND ALKENYL CHAINS EXTENDED BENZENE DERIVATIVES AND PHARMACEUTICAL COMPOSITION INCLUDING THE SAME TAIWANJ PHARMACEUTICALS CO., LTD. (TW) 2022-05-19 US disclosed
EP-3946299-A1 PERIPHERAL ALKYL AND ALKENYL CHAINS EXTENDED BENZENE DERIVATIVES AND PHARMACEUTICAL COMPOSITION INCLUDING THE SAME Taiwanj Pharmaceuticals Co., Ltd. (TW) 2022-02-09 EP disclosed
WO-2020205455-A1 PERIPHERAL ALKYL AND ALKENYL CHAINS EXTENDED BENZENE DERIVATIVES AND PHARMACEUTICAL COMPOSITION INCLUDING THE SAME TAIWANJ PHARMACEUTICALS, CO., LTD. (TW) 2020-10-08 WO disclosed
EP-2135858-A1 COMPOSITION FOR TEATING INFECTIOUS DISEASES Universidad De Zaragoza (ES) 2009-12-23 EP disclosed
WO-1988003147-A1 SELECTED N6-SUBSTITUTED ADENOSINES HAVING SELECTIVE A2 BINDING ACTIVITY WARNER-LAMBERT COMPANY (US) 1988-05-05 WO 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-20220153687-A1 PERIPHERAL ALKYL AND ALKENYL CHAINS EXTENDED BENZENE DERIVATIVES AND PHARMACEUTICAL COMPOSITION INCLUDING THE SAME AADAC, ENPP2, ATXN10 FBP1 431/4885MAOA 191/4885MAOB 149/4885

“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.