SCHEMBL7039202

SCHEMBL7039202

Cc1ccc(-c2ccc(CNC(=O)c3cc(NC(=O)c4ccccc4CCc4ccccc4)cn3C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
LMNA P02545 3/20 0.50
ADRB2 P07550 1/20 0.50
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
OPRL1 P41146 2/20 0.48
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KDR P35968 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL7252308 0.86 ALDH1A1 (0.58) ALDH1A1LMNAADRB2KDM4ESMN1; SMN2
SCHEMBL7037234 0.86 RXFP1 (0.46) ALDH1A1LMNAKDM4EL3MBTL1MEN1
SCHEMBL7039230 0.86 CHRNB2 (0.51) ALDH1A1LMNAKDM4EHTTL3MBTL1
SCHEMBL7039859 0.85 CHRNB2 (0.47) ALDH1A1LMNAKDM4EL3MBTL1MEN1
SCHEMBL7041358 0.83 ALDH1A1 (0.51) ALDH1A1LMNAHTTL3MBTL1MEN1
SCHEMBL7041084 0.81 LMNA (0.46) ALDH1A1LMNAMEN1KMT2APOLB
SCHEMBL7041929 0.81 L3MBTL1 (0.50) ALDH1A1LMNAKDM4ESMN1; SMN2L3MBTL1
SCHEMBL7038646 0.79 KMT2A (0.54) ALDH1A1LMNAKDM4ESMN1; SMN2HTT
SCHEMBL7035898 0.79 MTTP (0.50) KDM4EGAA
SCHEMBL7036532 0.79 POLB (0.54) ALDH1A1LMNAKDM4EHTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030162788-A1 Combination of MTP inhibitors or apoB-secretion inhibitors with fibrates for use as pharmaceuticals BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-08-28 US disclosed
US-20030073836-A1 Heteroarylcarboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-04-17 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 (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-20030162788-A1 Combination of MTP inhibitors or apoB-secretion inhibitors with fibrates for use as pharmaceuticals APOB, LIPC, MTPN ALDH1A1 2713/4885LMNA 1024/4885ADRB2 1441/4885
US-20030073836-A1 Heteroarylcarboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions MTTP, CETP, CES1 ALDH1A1 756/4885LMNA 2520/4885ADRB2 1898/4885

“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.