SCHEMBL376355

SCHEMBL376355

OC1(Cc2ccccc2Cl)CCC2(CC1)OCCO2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
C5AR1 P21730 1/20 0.38
CYP2A13 Q16696 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MGLL Q99685 1/20 0.36
HSD11B1 P28845 1/20 0.36
RXFP1 Q9HBX9 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
SCHEMBL30447423 0.83 HSD17B10 (0.34) ALDH1A1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL24203798 0.83 HSD17B10 (0.34) ALDH1A1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL376664 0.81 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ACYP2A13NPC1
SCHEMBL26011311 0.81 L3MBTL1 (0.35) ALDH1A1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL376848 0.81 CYP2A13 (0.37) ALDH1A1MEN1KMT2ACYP2A13NPC1
SCHEMBL376479 0.81 MAPK1 (0.41) ALDH1A1MEN1KMT2ASLC6A4SLC6A3
SCHEMBL17740237 0.79 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL30448111 0.78 L3MBTL1 (0.35) ALDH1A1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL376854 0.78 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL24203765 0.78 L3MBTL1 (0.35) ALDH1A1MEN1KMT2ACYP3A4CYP2C9

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
EP-1765778-B1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2012-01-25 EP disclosed
US-20100035879-A1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES 2010-02-11 US disclosed
US-20100035879-A1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES 2010-02-11 US disclosed
US-20100035879-A1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES 2010-02-11 US disclosed
US-7585858-B2 N-sulfonylcarboximidamide apoptosis promoters ABBOTT LABORATORIES (US) 2009-09-08 US disclosed
US-20050272744-A1 N-sulfonylcarboximidamide apoptosis promoters ABBVIE INC. 2005-12-08 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 (2 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-20100035879-A1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BAD ALDH1A1 2354/4885MEN1 4383/4885KMT2A 1794/4885
US-20050272744-A1 N-sulfonylcarboximidamide apoptosis promoters BAX, BCL2, BAD ALDH1A1 2354/4885MEN1 4383/4885KMT2A 1794/4885

“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.