SCHEMBL4411541

SCHEMBL4411541

O=c1[c]ncc(C(F)(F)F)[nH]1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.34
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 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
SCHEMBL16541081 0.67
SCHEMBL1571817 0.64
SCHEMBL8596528 0.61 NOTUM (0.34) KDM4EALDH1A1HPGD
SCHEMBL11256496 0.59 HTT (0.37) KDM4E
SCHEMBL17351370 0.58 DGAT1 (0.35)
Hydrochloric Acid SCHEMBL22188751 0.58 MASP2 (0.38) KDM4EALDH1A1
SCHEMBL20589156 0.58 MASP2 (0.38) KDM4EALDH1A1
SCHEMBL4406506 0.57
SCHEMBL20526119 0.57
Ammonia Solution, Strong SCHEMBL29243752 0.57 HRH1 (0.38) KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506169-B1 METHOD FOR THE PRODUCTION OF SULPHONIC ACID DIAMIDES BASF SE (DE) 2009-12-23 EP disclosed
US-7232926-B2 Method for the production of sulphamic acid halogenides BASF AKTIENGESELLSCHAFT (DE) 2007-06-19 US disclosed
US-20050159622-A1 Method for the production of sulphamic acid halogenides BASF AKTIENGESELLSCHAFT (DE) 2005-07-21 US disclosed
EP-1506169-A1 METHOD FOR THE PRODUCTION OF SULPHAMIC ACID HALOGENIDES BASF AKTIENGESELLSCHAFT (DE) 2005-02-16 EP disclosed
WO-2003097589-A1 METHOD FOR THE PRODUCTION OF SULPHAMIC ACID HALOGENIDES BASF AKTIENGESELLSCHAFT (DE) 2003-11-27 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-20050159622-A1 Method for the production of sulphamic acid halogenides AS3MT, ARSA, SRM KDM4E 2634/4885CRHBP 4858/4885CRHR2 4768/4885

“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.