SCHEMBL3321844

SCHEMBL3321844

FC(F)CN1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
MAPT P10636 2/20 0.44
ATM Q13315 2/20 0.44
ANPEP P15144 1/20 0.41
ERAP2 Q6P179 1/20 0.41
HSD17B10 Q99714 1/20 0.40
HRH3 Q9Y5N1 2/20 0.39
GAA P10253 1/20 0.37
ALDH1A1 P00352 3/20 0.36
HPGD P15428 1/20 0.36
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
LMNA P02545 1/20 0.35
CHRM5 P08912 1/20 0.35
ADRA2C P18825 1/20 0.35
HTT P42858 1/20 0.34
ACHE P22303 1/20 0.34
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL3321849 1.00 MEN1 (0.55) MEN1KMT2AMAPTATMANPEP
Hydrochloric Acid SCHEMBL25413104 0.97 MEN1 (0.52) MEN1KMT2AMAPTATMANPEP
SCHEMBL1055186 0.97
Hydrochloric Acid SCHEMBL22468575 0.94 MEN1 (0.48) MEN1KMT2AMAPTATMANPEP
SCHEMBL19125455 0.91
Hydrochloric Acid SCHEMBL31473856 0.88
SCHEMBL14498532 0.78 MEN1 (0.50) MEN1KMT2AMAPTATMANPEP
SCHEMBL29602162 0.78 MEN1 (0.50) MEN1KMT2AMAPTATMANPEP
SCHEMBL19045072 0.76 CXCR4 (0.50) MEN1KMT2AHRH3CHRM5ADRA2C
SCHEMBL19045069 0.76 CHKA (0.43) MAPTGAAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100104659-A1 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2010-04-29 US disclosed
EP-2041141-A2 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2009-04-01 EP disclosed
WO-2008006883-A2 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2008-01-17 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-20100104659-A1 BENZOPYRANOPYRAZOLES BAX, BCL2, BAD MEN1 4734/4885KMT2A 3784/4885MAPT 3659/4885

“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.