SCHEMBL5715977

SCHEMBL5715977

Fc1c(F)c(F)c(N2CCC2)c(F)c1F

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
CA13 Q8N1Q1 2/20 0.50
CA9 Q16790 1/20 0.50
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL5716130 0.94 ALDH1A1 (0.56) ALDH1A1LMNACA12CA1CA2
SCHEMBL5716127 0.91 CA12 (0.59) ALDH1A1LMNACA12CA1CA2
Hydrochloric Acid SCHEMBL7605265 0.91 ALDH1A1 (0.61) ALDH1A1LMNACA12CA1CA2
SCHEMBL6440013 0.87 ALDH1A1 (0.62) ALDH1A1LMNACA12CA1CA2
SCHEMBL5716012 0.80 CA12 (0.46) ALDH1A1LMNACA12CA1CA2
SCHEMBL5716136 0.78 CA12 (0.48) ALDH1A1LMNACA12CA1CA2
SCHEMBL14922295 0.75 ALDH1A1 (0.50) ALDH1A1LMNACA12CA1CA2
SCHEMBL6581764 0.71 CA12 (0.47) ALDH1A1LMNACA12CA1CA2
SCHEMBL21675441 0.71 ALDH1A1 (0.46) ALDH1A1LMNACA12CA1CA2
SCHEMBL17091739 0.70 CA12 (0.96) ALDH1A1LMNACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1661900-A1 Olefin polymerization cocatalysts derived from group-15 cationic compounds and processes using them ExxonMobil Chemical Patents Inc. (US) 2006-05-31 EP claimed
EP-1252166-B1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM EXXONMOBIL CHEM PATENTS INC (US) 2005-11-09 EP claimed
US-6822057-B2 OLEFIN POLYMERIZATION CATALYST SYSTEM IS A REACTION PRODUCT OF A METALLOCENES AND A COCATALYST CONTAINING FLUOROARYL SUBSTITUTED SECONDARY AMINE OR PHSOPHINE COMPOUND AND AN ANION CONTAINING GROUP 13 ELEMENT WHICH IS NONCOORDINATIG EXXON MOBIL CHEMICAL PATENTS INC. 2004-11-23 US claimed
JP-2004500359-A 2004-01-08 JP claimed
EP-1252166-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2002-10-30 EP claimed
WO-2001042249-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2001-06-14 WO claimed
US-20040006101-A1 Quinolinone derivatives CHIRON CORPORATION 2004-01-08 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-20040006101-A1 Quinolinone derivatives SLCO1B1, SLCO1B3, SLCO1A2 ALDH1A1 232/4885LMNA 2734/4885CA12 1637/4885

“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.