SCHEMBL16232156

SCHEMBL16232156

Cc1cccc([C@@H]2C[C@H]2C(=O)Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.50
LPAR2 Q9HBW0 1/20 0.50
HTR2C P28335 3/20 0.49
HTR2A P28223 1/20 0.49
SLC6A4 P31645 1/20 0.49
HTR2B P41595 1/20 0.49
SLC6A3 Q01959 1/20 0.49
SLC9A1 P19634 2/20 0.46
ALDH1A1 P00352 3/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
ALOX12 P18054 1/20 0.44
GPR88 Q9GZN0 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC4 P56524 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL7868650 0.86 FFAR1 (0.65) FFAR1LPAR2HTR2CHTR2ASLC6A4
SCHEMBL21501054 0.86 FFAR1 (0.65) FFAR1LPAR2HTR2CHTR2ASLC6A4
SCHEMBL23116570 0.86 FFAR1 (0.65) FFAR1LPAR2HTR2CHTR2ASLC6A4
SCHEMBL10288305 0.86 FFAR1 (0.65) FFAR1LPAR2HTR2CHTR2ASLC6A4
SCHEMBL3042239 0.86 FFAR1 (0.65) FFAR1LPAR2HTR2CHTR2ASLC6A4
SCHEMBL29303274 0.85 HTR2A (0.51) FFAR1LPAR2HTR2CHTR2ASLC6A4
SCHEMBL29136846 0.81 SLC9A1 (0.66) HTR2CHTR2AHTR2BSLC6A3SLC9A1
SCHEMBL29830097 0.81 SLC9A1 (0.66) HTR2CHTR2AHTR2BSLC6A3SLC9A1
SCHEMBL29136847 0.81 SLC9A1 (0.66) HTR2CHTR2AHTR2BSLC6A3SLC9A1
SCHEMBL24737783 0.81 SLC9A1 (0.66) HTR2CHTR2AHTR2BSLC6A3SLC9A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140336198-A1 Amine Derivatives as Potassium Channel Blockers MERCK PATENT GMBH (DE) 2014-11-13 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-20140336198-A1 Amine Derivatives as Potassium Channel Blockers KCNA3, KCNH3, KCNK3 FFAR1 2942/4885LPAR2 1257/4885HTR2C 2143/4885

“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.