SCHEMBL1241982

SCHEMBL1241982

CN(C)CCc1nnc(Cl)s1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ HRH3 Q9Y5N1 2/20 0.33
▸ FBP1 P09467 1/20 0.32
▸ PIM1 P11309 1/20 0.31
▸ PIM2 Q9P1W9 1/20 0.31
▸ AOC3 Q16853 1/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL1241280 0.88 HRH3 (0.40) TAAR1KDM4EHRH3PIM1PIM2
SCHEMBL12263493 0.77 NPC1 (0.36) TAAR1KDM4EHRH3MAPK1
SCHEMBL10401931 0.75 KDM4E (0.35) TAAR1KDM4EHRH3
SCHEMBL10401930 0.75 KDM4E (0.35) TAAR1KDM4EHRH3
SCHEMBL1241938 0.75 POLB (0.57) —
SCHEMBL12890997 0.72 CYP3A4 (0.37) KDM4EHRH3MEN1KMT2A
SCHEMBL7992417 0.67 — —
SCHEMBL16327123 0.65 ALDH1A1 (0.36) KDM4EHRH3MAPK1
SCHEMBL12787948 0.65 ALDH1A1 (0.46) MEN1KMT2A
SCHEMBL10403434 0.65 KMT2A (0.37) KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7879808-B2 potent activity against resistant pneumococci; for treating domestic fowl MEIJI SEIKA KAISHA, LTD. (JP) 2011-02-01 — — US disclosed
US-20100210570-A1 LINCOMYCIN DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2010-08-19 — — US disclosed
EP-2151447-A1 LINCOMYCIN DERIVATIVES AND ANTIBACTERIAL AGENTS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Meiji Seika Kaisha Ltd. (JP) 2010-02-10 — — EP 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-20100210570-A1 LINCOMYCIN DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT LAS1L, LCLAT1, LYPLA1 TAAR1 4340/4885KDM4E 3818/4885HRH3 2518/4885

“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.

Send feedback