SCHEMBL2200085

SCHEMBL2200085

C=CCOc1ccc(C(=O)c2ccc(N)cc2Cl)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.41
GAA P10253 3/20 0.40
TSHR P16473 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
MCL1 Q07820 1/20 0.39
FLT3 P36888 1/20 0.39
CHRNA4 P43681 2/20 0.39
CHRM2 P08172 1/20 0.39
CHRM3 P20309 1/20 0.39
MAOA P21397 1/20 0.39
HTR2C P28335 1/20 0.39
HTR3A P46098 1/20 0.39
KCNH2 Q12809 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
MAPT P10636 4/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.37
POLB P06746 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37

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
SCHEMBL5176008 0.85 MAPT (0.50) NR1H4GAATSHRALDH1A1HPGD
SCHEMBL2195369 0.82 NR1H4 (0.42) NR1H4GAAALDH1A1MCL1CHRNA4
SCHEMBL2200102 0.82 KDM4E (0.46) NR1H4GAAALDH1A1HPGDMCL1
SCHEMBL2198439 0.82 MAPT (0.59) NR1H4GAAALDH1A1MAPTRAB9A
SCHEMBL5172405 0.81 RAB9A (0.54) NR1H4GAAALDH1A1HPGDCHRNA4
SCHEMBL2200351 0.78 MAPK14 (0.66) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL1607883 0.76 GAA (0.49) GAATSHRALDH1A1HPGDMCL1
SCHEMBL11131010 0.76 ALDH1A1 (0.48) GAAALDH1A1HPGDFLT3CHRNA4
SCHEMBL5174662 0.75 RAB9A (0.48) TSHRALDH1A1MAPTRAB9ANPC1
SCHEMBL6023362 0.74 MAPK13 (0.42) ALDH1A1HPGDMAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977387-B2 Aminobenzophenone compounds LEO PHARMA A/S (DK) 2011-07-12 US disclosed
CN-1826310-B Novel aminobenzophenone compounds LEO PHARMA AS 2010-07-21 CN disclosed
CN-1826310-A Novel aminobenzophenone compounds LEO PHARMA AS (DK) 2006-08-30 CN disclosed
US-20060166990-A1 Novel aminobenzophenone compounds LEO PHARMA A/S (DK) 2006-07-27 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-20060166990-A1 Novel aminobenzophenone compounds NFKBIA, UACA, ALDH7A1 NR1H4 629/4885GAA 2276/4885TSHR 4539/4885

“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.