SCHEMBL4498993

SCHEMBL4498993

O=C(O)C1CCCN(C(=O)Cc2ccccn2)C1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
CREBBP Q92793 1/20 0.50
KDM4E B2RXH2 2/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
PAX8 Q06710 2/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CNR1 P21554 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL10574538 0.82 ALDH1A1 (0.58) ALDH1A1L3MBTL1KDM4EPOLBPAX8
SCHEMBL31367822 0.82 KDM2B (0.51) ALDH1A1L3MBTL1CREBBPKDM4EPOLB
SCHEMBL18184641 0.79 PAX8 (0.49) ALDH1A1MAPK1L3MBTL1KDM4EPAX8
SCHEMBL4485387 0.78 PLA2G1B (0.65) ALDH1A1L3MBTL1MEN1KMT2ACYP3A4
SCHEMBL4485391 0.78 PLA2G1B (0.65) ALDH1A1L3MBTL1MEN1KMT2ACYP3A4
SCHEMBL26123795 0.78 L3MBTL1 (0.50) ALDH1A1L3MBTL1KDM4ESIGMAR1
SCHEMBL8097066 0.78 SLC6A1 (0.57) ALDH1A1L3MBTL1CYP2C9
SCHEMBL6037163 0.76 KDM4E (0.70) ALDH1A1MAPK1KDM4EPOLBMEN1
SCHEMBL10572949 0.75 ALDH1A1 (0.56) ALDH1A1L3MBTL1KDM4EPOLBCNR1
SCHEMBL6850544 0.74 HPGD (0.52) ALDH1A1MAPK1L3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7598392-B2 2-amido-4-phenylthiazole derivatives, the preparation and the therapeutic use thereof SANOFI-AVENTIS (FR) 2009-10-06 US claimed
US-20070259847-A1 2-Amido-4-phenylthiazole Derivatives, The Preparation And The Therapeutic Use Thereof SANOFI-AVENTIS (FR) 2007-11-08 US claimed
US-7598392-B2 2-amido-4-phenylthiazole derivatives, the preparation and the therapeutic use thereof SANOFI-AVENTIS (FR) 2009-10-06 US disclosed
US-20070259847-A1 2-Amido-4-phenylthiazole Derivatives, The Preparation And The Therapeutic Use Thereof SANOFI-AVENTIS (FR) 2007-11-08 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-20070259847-A1 2-Amido-4-phenylthiazole Derivatives, The Preparation And The Therapeutic Use Thereof PKD2, TPMT, PKD1 ALDH1A1 950/4885MAPK1 3851/4885L3MBTL1 2849/4885

“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.