SCHEMBL4309533

SCHEMBL4309533

O=C(Nc1cccc2c1C(=O)N(CCC(=O)N1CCNCC1)C2)c1ccc(Cl)s1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 2/20 0.38
MCL1 Q07820 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
F2 P00734 2/20 0.37
TP53 P04637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
NR1I2 O75469 1/20 0.36
UGCG Q16739 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
SCHEMBL4313283 0.86 F10 (0.53) F10ALDH1A1MAPK1HPGDSMN1; SMN2
SCHEMBL13950123 0.85 F10 (0.44) F10SMN1; SMN2F2L3MBTL1KMT2A
SCHEMBL4309505 0.83 PARP1 (0.44) F10ALDH1A1MAPK1MCL1HPGD
SCHEMBL4306015 0.83 ALDH1A1 (0.42) F10ALDH1A1MAPK1HPGDSMN1; SMN2
SCHEMBL13950126 0.80 NR1I2 (0.41) F10ALDH1A1HPGDSMN1; SMN2F2
SCHEMBL6221617 0.79 ALDH1A1 (0.36) ALDH1A1MAPK1MCL1SMN1; SMN2TP53
SCHEMBL4308690 0.78 STK33 (0.40) F10ALDH1A1HPGDSMN1; SMN2F2
SCHEMBL4309214 0.77 CHRM3 (0.43) F10ALDH1A1MAPK1MCL1HPGD
SCHEMBL3382279 0.77 F10 (0.49) F10ALDH1A1MAPK1MCL1HPGD
SCHEMBL4309230 0.76 F10 (0.45) F10ALDH1A1SMN1; SMN2F2L3MBTL1

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-7482472-B2 Substituted isoindoles and their use BAYER HEALTHCARE AG (DE) 2009-01-27 US disclosed
US-7482472-B2 Substituted isoindoles and their use BAYER HEALTHCARE AG (DE) 2009-01-27 US disclosed
US-7482472-B2 Substituted isoindoles and their use BAYER HEALTHCARE AG (DE) 2009-01-27 US disclosed
US-20080039446-A1 Substituted isoindoles and their use BAYER HEALTHCARE AG (DE) 2008-02-14 US disclosed
US-20080039446-A1 Substituted isoindoles and their use BAYER HEALTHCARE AG (DE) 2008-02-14 US disclosed
US-20080039446-A1 Substituted isoindoles and their use BAYER HEALTHCARE AG (DE) 2008-02-14 US disclosed
US-7189738-B2 Substituted isoindoles and their use thereof BAYER HEALTHCARE AG (DE) 2007-03-13 US disclosed
US-7189738-B2 Substituted isoindoles and their use thereof BAYER HEALTHCARE AG (DE) 2007-03-13 US disclosed
US-7189738-B2 Substituted isoindoles and their use thereof BAYER HEALTHCARE AG (DE) 2007-03-13 US disclosed
EP-1414817-B1 substituted isoindoles and the use thereof BAYER HEALTHCARE AG (DE) 2005-04-06 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-20080039446-A1 Substituted isoindoles and their use F2, F12, TFPI2 F10 19/4885ALDH1A1 346/4885MAPK1 4415/4885

“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.