SCHEMBL29900751

SCHEMBL29900751

CC(C)(C)N1C[C@H](C(=O)Nc2cccc3c(Cl)nccc23)[C@@H](c2ccccc2)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MC1R Q01726 9/20 0.44
KDM4E B2RXH2 1/20 0.38
FABP7 O15540 2/20 0.38
FABP3 P05413 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
LMNA P02545 2/20 0.35
NAMPT P43490 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL23924233 0.85 KDM4E (0.38) KDM4EFABP7FABP3LMNANAMPT
SCHEMBL29900573 0.85 FABP7 (0.53) MC1RKDM4EFABP7FABP3HRH3
SCHEMBL23951748 0.84 TACR1 (0.51)
SCHEMBL29900624 0.82 EPHX2 (0.47) ALDH1A1HTTSMN1; SMN2
SCHEMBL29900566 0.82 EPHX2 (0.47) ALDH1A1HTTSMN1; SMN2
SCHEMBL29900665 0.80 TRPV1 (0.39) MC1RSMN1; SMN2
SCHEMBL29900723 0.80 TNKS (0.49) MC1RKDM4EALDH1A1GAAHTT
SCHEMBL29900780 0.80 TNKS (0.49) MC1RKDM4EALDH1A1GAAHTT
SCHEMBL29900714 0.80 MC1R (0.39) MC1RKDM4EFABP7FABP3HRH3
SCHEMBL23951695 0.79 ROCK2 (0.52)

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-20220213061-A9 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 TES PHARMA S.R.L. (IT) 2022-07-07 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-20220213061-A9 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 NR2E3, NR2F2, NR2C2 MC1R 720/4885KDM4E 2961/4885FABP7 666/4885

“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.