SCHEMBL1775632

SCHEMBL1775632

O=C(O)N1CCC(Oc2ccc(NS(=O)(=O)c3ccc(Cl)s3)c3ccccc23)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.45
MCOLN3 Q8TDD5 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MEN1 O00255 7/20 0.43
KMT2A Q03164 7/20 0.43
MAPT P10636 6/20 0.43
LMNA P02545 5/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
HTT P42858 5/20 0.41
PTGES2 Q9H7Z7 1/20 0.40
RECQL P46063 3/20 0.39
POLB P06746 2/20 0.39
HTR1A P08908 2/20 0.38
HTR7 P34969 2/20 0.38
BCAT2 O15382 1/20 0.38
DRD2 P14416 1/20 0.38
HTR6 P50406 1/20 0.38
PGAM1 P18669 1/20 0.38
PIK3CA P42336 1/20 0.37
F10 P00742 1/20 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
SCHEMBL1775295 0.94 CCR2 (0.44) CCR2MCOLN3ALDH1A1MEN1KMT2A
SCHEMBL1776784 0.83 HKDC1 (0.51) CCR2MEN1KMT2APOLB
SCHEMBL1775259 0.83 PTGES2 (0.44) CCR2MCOLN3ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL1774696 0.82 PTGES2 (0.43) CCR2MCOLN3ALDH1A1MEN1KMT2A
SCHEMBL1775494 0.80 PTGES2 (0.42) CCR2MCOLN3ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL1774599 0.79 PTGES2 (0.42) CCR2MCOLN3ALDH1A1MEN1KMT2A
SCHEMBL1775450 0.78 HKDC1 (0.49) CCR2MEN1KMT2APOLB
SCHEMBL1774949 0.78 KEAP1 (0.58) ALDH1A1MAPTLMNASMN1; SMN2L3MBTL1
SCHEMBL1775648 0.78 HKDC1 (0.49) CCR2MEN1KMT2APOLB
SCHEMBL6440516 0.78 HKDC1 (0.49) CCR2MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
US-20040024210-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2004-02-05 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-20040024210-A1 New compounds SULT1E1, SULT2A1, SULT1A1 CCR2 942/4885MCOLN3 2770/4885ALDH1A1 705/4885

“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.