SCHEMBL5785459

SCHEMBL5785459

N#CCc1ccc(CN2C(=O)c3cccc(NC(=O)c4ccc(Cl)s4)c3C2O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.43
STK33 Q9BYT3 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
NPC1 O15118 4/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
ACKR3 P25106 1/20 0.34
KMT2A Q03164 6/20 0.34
KDM4E B2RXH2 5/20 0.34
MEN1 O00255 4/20 0.34
RAB9A P51151 3/20 0.34
TSHR P16473 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
PRSS12 P56730 1/20 0.34
TP53 P04637 1/20 0.33
HDAC1 Q13547 1/20 0.33

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
SCHEMBL3991573 0.90 F10 (0.43) F10STK33SMN1; SMN2ALDH1A1HPGD
SCHEMBL5780260 0.86 HPGD (0.41) F10STK33SMN1; SMN2ALDH1A1HPGD
SCHEMBL6407626 0.82 F10 (0.50) F10STK33SMN1; SMN2ALDH1A1HPGD
SCHEMBL3982271 0.82 F10 (0.41) F10STK33SMN1; SMN2ALDH1A1HPGD
SCHEMBL5782334 0.82 NPC1 (0.33) HPGDNPC1MAPTLMNAHTT
SCHEMBL5781704 0.80 F10 (0.45) F10STK33SMN1; SMN2ALDH1A1HPGD
SCHEMBL5781417 0.79 F10 (0.65) F10STK33SMN1; SMN2ALDH1A1HPGD
SCHEMBL5783337 0.78 F10 (0.43) F10STK33SMN1; SMN2ALDH1A1HPGD
SCHEMBL6408829 0.78 F10 (0.46) F10STK33SMN1; SMN2ALDH1A1HPGD
SCHEMBL5781798 0.77 F10 (0.49) F10STK33SMN1; SMN2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408962-B1 SUBSTITUTED ISOINDOLES AND THE USE THEREOF BAYER HEALTHCARE AG (DE) 2006-03-15 EP disclosed
US-6933295-B2 Substituted isoindoles and the use thereof BAYER AKTIENGESELLSCHAFT (DE) 2005-08-23 US disclosed
US-20050004207-A1 Nitrogen compounds such as N-(2-{4-[2-Amino-2-(hydroxyimino)ethyl]benzyl}-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl)-5-chloro-2-thiophenecarboxamide, used as blood-coagulation factor Xa antogonists for prophylaxis of cardiovascular disorders BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-01-06 US disclosed
EP-1408962-A1 SUBSTITUTED ISOINDOLES AND THE USE THEREOF Bayer HealthCare AG (DE) 2004-04-21 EP disclosed
WO-2003007942-A1 SUBSTITUTED ISOINDOLES AND THE USE THEREOF BAYER HEALTHCARE AG (DE) 2003-01-30 WO 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-20050004207-A1 Nitrogen compounds such as N-(2-{4-[2-Amino-2-(hydroxyimino)ethyl]benzyl}-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl)-5-chloro-2-thiophenecarboxamide, used as blood-coagulation factor Xa antogonists for prophylaxis of cardiovascular disorders F2, SERPINC1, F11 F10 4/4885STK33 3056/4885SMN1; SMN2 4230/4885

“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.