SCHEMBL3015869

SCHEMBL3015869

Cc1ccc(C)c(CC(=O)CCl)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TAAR1 Q96RJ0 1/20 0.44
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 2/20 0.39
JAK2 O60674 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
PTGS2 P35354 3/20 0.38
KDM4E B2RXH2 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
SRC P12931 1/20 0.38
MITF O75030 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
SCHEMBL3015011 0.85 SMN1; SMN2 (0.49) HTTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL27959986 0.83 TAAR1 (0.46) HTTSMN1; SMN2TAAR1RAB9ANPC1
SCHEMBL29606577 0.81 TAAR1 (0.47) HTTALDH1A1SMN1; SMN2TAAR1RAB9A
SCHEMBL37438 0.81 TAAR1 (0.47) HTTALDH1A1SMN1; SMN2TAAR1RAB9A
SCHEMBL9969945 0.79 TAAR1 (0.48) HTTTAAR1RAB9ANPC1SLC22A12
SCHEMBL1259688 0.79 TAAR1 (0.48) HTTALDH1A1TAAR1RAB9ANPC1
SCHEMBL37138 0.79 SRC (0.58) ALDH1A1SMN1; SMN2TAAR1RAB9ANPC1
SCHEMBL29375293 0.79 SRC (0.58) ALDH1A1SMN1; SMN2TAAR1RAB9ANPC1
SCHEMBL14077960 0.77 NLRP3 (0.43) HTTALDH1A1SMN1; SMN2TAAR1RAB9A
SCHEMBL25709157 0.77 TAAR1 (0.41) HTTTAAR1RAB9ANPC1SLC22A12

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-8722681-B2 N-sulfonyl thiazolylpiperazine derivatives and related N-sulfonyl heterocyclic derivatives for the treatment of neuro degenerative diseases NV REMYND (BE) 2014-05-13 US disclosed
US-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES NV REMYND (BE) 2010-08-05 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-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES SMN1; SMN2, HTT, SNCA HTT 2/4885ALDH1A1 3510/4885SMN1; SMN2 1/4885

“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.