SCHEMBL4120558

SCHEMBL4120558

Fc1ccc(Cl)c(Cl)c1Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.40
TYMP P19971 1/20 0.39
PNMT P11086 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
HIF1A Q16665 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TAAR1 Q96RJ0 1/20 0.36
P2RX7 Q99572 2/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 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
SCHEMBL21971599 0.78 LMNA (0.55) ALDH1A1SMN1; SMN2KDM4ELMNAMEN1
SCHEMBL7582785 0.77 MEN1 (0.49) CALM1ALDH1A1LMNATYMPMEN1
SCHEMBL28232331 0.77 CALM1 (0.41) CALM1ALDH1A1TYMPPNMTMEN1
SCHEMBL16933813 0.77 IDH1 (0.44) CALM1ALDH1A1TYMPP2RX7
SCHEMBL28403410 0.76 CSNK2A1 (0.43) CALM1ALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL11523704 0.74 CALM1 (0.58) CALM1ALDH1A1TYMPMEN1KMT2A
SCHEMBL11521959 0.72 CALM1 (0.55) CALM1ALDH1A1TYMPMEN1KMT2A
SCHEMBL4120436 0.71 TAAR1 (0.36) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL6072548 0.71 TAAR1 (0.36) CYP3A4TAAR1P2RX7HTTGAA
SCHEMBL6072587 0.71 TAAR1 (0.41) SMN1; SMN2KDM4ELMNAMEN1KMT2A

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-20090253929-A1 Chemical Compounds ASTRAZENECA AB (SE) 2009-10-08 US disclosed
EP-1824806-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2007-08-29 EP disclosed
WO-2006062476-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2006-06-15 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-20090253929-A1 Chemical Compounds CYP4B1, CYP3A4, CYP1A1 CALM1 3443/4885ALDH1A1 319/4885SMN1; SMN2 4138/4885

“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.