SCHEMBL17738883

SCHEMBL17738883

CC(C)(F)C(=O)N1CCN(c2cc(Cl)cc3[nH]ncc23)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
IDE P14735 1/20 0.41
KMT2A Q03164 1/20 0.41
TRPV1 Q8NER1 8/20 0.41
GOT1 P17174 1/20 0.39
RPS6KB1 P23443 1/20 0.38
MAPT P10636 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37
ROCK2 O75116 2/20 0.36
CYP3A4 P08684 2/20 0.36

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
SCHEMBL17738876 0.90 MEN1 (0.42) MEN1IDEKMT2ATRPV1GOT1
SCHEMBL21894564 0.84 CLK1 (0.47) TRPV1GOT1RPS6KB1MAPTIDO1
SCHEMBL20580826 0.84 IDO1 (0.46) MEN1KMT2ATRPV1MAPTIDO1
SCHEMBL17738872 0.82 TRPV1 (0.44) TRPV1GOT1RPS6KB1IDO1TDO2
SCHEMBL17738811 0.81 TRPV1 (0.49) TRPV1GOT1RPS6KB1
SCHEMBL22057189 0.81 TRPV1 (0.44) TRPV1GOT1RPS6KB1IDO1TDO2
SCHEMBL17738817 0.81 GOT1 (0.43) MEN1KMT2ATRPV1GOT1RPS6KB1
SCHEMBL17738569 0.81 CYP3A4 (0.45) TRPV1GOT1MAPTLMNAROCK2
SCHEMBL17738881 0.81 TSHR (0.47) MEN1KMT2ATRPV1GOT1MAPT
SCHEMBL22057847 0.81 CYP3A4 (0.46) TRPV1GOT1RPS6KB1ROCK2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11130738-B2 Pharmaceutical compound IOMET PHARMA LTD. (GB) 2021-09-28 US disclosed
US-20200172492-A1 PHARMACEUTICAL COMPOUND IOMET PHARMA LTD. (GB) 2020-06-04 US disclosed
US-10590086-B2 Pharmaceutical compound IOMET PHARMA LTD. (GB) 2020-03-17 US disclosed
WO-2016071293-A2 PHARMACEUTICAL COMPOUND IOMET PHARMA LTD (GB) 2016-05-12 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 (3 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-11130738-B2 Pharmaceutical compound IDO1, TDO2, IDO2 MEN1 3028/4885IDE 308/4885KMT2A 2123/4885
US-20200172492-A1 PHARMACEUTICAL COMPOUND IDO1, TDO2, IDO2 MEN1 3028/4885IDE 308/4885KMT2A 2123/4885
US-10590086-B2 Pharmaceutical compound IDO1, TDO2, IDO2 MEN1 3028/4885IDE 308/4885KMT2A 2123/4885

“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.