SCHEMBL18324802

SCHEMBL18324802

CC(=O)N1CC=C(c2c[nH]c3cc(C(F)(F)F)ccc23)CC1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.52
HTR1D P28221 1/20 0.50
TDO2 P48775 1/20 0.47
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.45
TP53 P04637 1/20 0.45
QDPR P09417 1/20 0.43

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
SCHEMBL18324892 0.91 MAPT (0.52) MAPTLMNA
SCHEMBL16801502 0.85 MAPT (0.59) MAPTTDO2LMNAPOLBTP53
SCHEMBL16801678 0.83 SLC6A4 (0.56) MAPTHTR1DTDO2LMNAPOLB
SCHEMBL7867998 0.83 SLC6A4 (0.63) LMNAPOLB
SCHEMBL21758836 0.83 MAPT (0.45) MAPTHTR1DTDO2LMNAPOLB
SCHEMBL16801665 0.81 SLC6A4 (0.59) MAPTTDO2LMNAPOLBTP53
SCHEMBL18324766 0.81 SLC6A4 (0.49) MAPTTDO2LMNAPOLBQDPR
SCHEMBL18324806 0.80 TDO2 (0.67) MAPTHTR1DTDO2LMNAPOLB
SCHEMBL11864713 0.80 LMNA (0.66) MAPTTDO2LMNAPOLBTP53
SCHEMBL16801687 0.79 SLC6A4 (0.69) TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3082802-B1 TRYPTOPHAN-2,3-DIOXYGENASE (TDO) AND/OR INDOLAMINE-2,3-DIOXYGENASE (IDO) INHIBITORS AND THEIR USE IOMET PHARMA LTD (GB) 2020-02-26 EP disclosed
US-9931347-B2 Pharmaceutical compound IOMET PHARMA LTD. (US) 2018-04-03 US disclosed
US-9931347-B2 Pharmaceutical compound IOMET PHARMA LTD. (US) 2018-04-03 US disclosed
US-20160367564-A1 Pharmaceutical Compound IOMET PHARMA LTD. (GB) 2016-12-22 US disclosed
US-20160367564-A1 Pharmaceutical Compound IOMET PHARMA LTD. (GB) 2016-12-22 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-20160367564-A1 Pharmaceutical Compound TDO2, IDO1, IDO2 MAPT 2964/4885HTR1D 225/4885TDO2 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.