SCHEMBL1027365

SCHEMBL1027365

Cc1nc(-c2ccc(C)c(NCC(=O)N(CCNC(C)C)CC(=O)N(C)N3Cc4ccc(F)cc4C3)c2)no1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
MAPK14 Q16539 2/20 0.34
HTR1D P28221 1/20 0.34
HTR1B P28222 1/20 0.34
HTR2A P28223 1/20 0.34
KIT P10721 5/20 0.33
P2RX3 P56373 2/20 0.32
TSHR P16473 1/20 0.32
ACKR3 P25106 3/20 0.32
NAMPT P43490 1/20 0.32
POLB P06746 1/20 0.32
THRB P10828 1/20 0.31

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
Hydrochloric Acid SCHEMBL1026435 0.99 LMNA (0.35) LMNAMAPK14HTR1DHTR1BHTR2A
SCHEMBL1024361 0.92 MAPK14 (0.37) LMNAMAPK14HTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL1027402 0.92 MAPK14 (0.36) LMNAMAPK14HTR1DHTR1BHTR2A
SCHEMBL1028674 0.91 LMNA (0.36) LMNAMAPK14HTR1DHTR1BHTR2A
SCHEMBL1027375 0.91 LMNA (0.38) LMNAMAPK14HTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL1025264 0.90 LMNA (0.35) LMNAMAPK14HTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL1027545 0.90 LMNA (0.38) LMNAMAPK14HTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL1026749 0.90 LMNA (0.36) LMNAMAPK14HTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL1025409 0.89 KIT (0.35) LMNAMAPK14HTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL1029002 0.88 NPY2R (0.32) ACKR3NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8513235-B2 Homocysteine synthase inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-08-20 US claimed
EP-2486925-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION Mitsubishi Tanabe Pharma Corporation (JP) 2012-08-15 EP claimed
US-20120196824-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-08-02 US claimed
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-02-10 US claimed
EP-2275404-A1 HOMOCYSTEINE SYNTHASE INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2011-01-19 EP claimed
US-8513235-B2 Homocysteine synthase inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-08-20 US disclosed
EP-2486925-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION Mitsubishi Tanabe Pharma Corporation (JP) 2012-08-15 EP disclosed
US-20120196824-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-08-02 US disclosed
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-02-10 US disclosed
EP-2275404-A1 HOMOCYSTEINE SYNTHASE INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2011-01-19 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 (2 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-20120196824-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION FABP7, TIMP3, MMP11 LMNA 3028/4885MAPK14 1666/4885HTR1D 4312/4885
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR BHMT, CBS, BHMT2 LMNA 2551/4885MAPK14 2008/4885HTR1D 1473/4885

“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.