SCHEMBL19350978

SCHEMBL19350978

CCCCCCC(C)Cc1ccc(Br)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.47
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ CSNK1E P49674 1/20 0.41
▸ BDKRB2 P30411 4/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SIGMAR1 Q99720 1/20 0.39
▸ NPC1 O15118 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ACE2 Q9BYF1 1/20 0.37
▸ HDAC3 O15379 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC2 Q92769 1/20 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
SCHEMBL28265214 1.00 LMNA (0.47) LMNACYP1A2CYP2D6CYP2C19CSNK1E
SCHEMBL18070687 0.84 LMNA (0.46) LMNACYP1A2CYP2D6CYP2C19KMT2A
SCHEMBL22930088 0.84 LMNA (0.46) LMNACYP1A2CYP2D6CYP2C19SIGMAR1
SCHEMBL22930103 0.84 LMNA (0.49) LMNACYP1A2CYP2D6CYP2C19CSNK1E
SCHEMBL22930105 0.84 LMNA (0.49) LMNACYP1A2CYP2D6CYP2C19CSNK1E
SCHEMBL19350974 0.82 LMNA (0.47) LMNACYP1A2CYP2D6CYP2C19CSNK1E
SCHEMBL9766502 0.82 CSNK1E (0.41) LMNACSNK1EBDKRB2KMT2AACE2
SCHEMBL9766510 0.82 CSNK1E (0.41) LMNACSNK1EBDKRB2KMT2AACE2
SCHEMBL20718669 0.82 PSMD14 (0.46) CSNK1EBDKRB2ACE2MAOAMAOB
SCHEMBL8466447 0.82 ESR1 (0.56) LMNACSNK1E

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-20170258805-A1 INHIBITORS OF UDP-GALACTOPYRANOSE MUTASE WISCONSIN ALUMNI RESEARCH FOUNDATION 2017-09-14 — — 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-20170258805-A1 INHIBITORS OF UDP-GALACTOPYRANOSE MUTASE UGDH, GALE, UGGT1 LMNA 4252/4885CYP1A2 2763/4885CYP2D6 1691/4885

“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