SCHEMBL6312871

SCHEMBL6312871

CCOC(=O)c1cnn(-c2cccc3ccccc23)c1C

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.56
RAB9A P51151 5/20 0.56
MAPT P10636 4/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
LMNA P02545 1/20 0.56
CDC25B P30305 2/20 0.53
HPGD P15428 4/20 0.52
NPC1 O15118 3/20 0.51
TSHR P16473 1/20 0.51
CDC25A P30304 1/20 0.50
CDC25C P30307 1/20 0.50
KMT2A Q03164 3/20 0.48
MEN1 O00255 1/20 0.48
TP53 P04637 1/20 0.48
HTT P42858 1/20 0.47
KDM4E B2RXH2 1/20 0.46
HIF1A Q16665 1/20 0.46

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
SCHEMBL859755 0.89 CDC25B (0.52) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL31117114 0.88 ALDH1A1 (0.66) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL1355820 0.88 ALDH1A1 (0.66) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL20278376 0.88 ALDH1A1 (0.50) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL20278464 0.85 MAPT (0.50) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL20265581 0.85 HPGD (0.58) ALDH1A1MAPTCDC25BHPGDNPC1
SCHEMBL18355731 0.84 MAPT (0.59) ALDH1A1RAB9AMAPTSMN1; SMN2HPGD
SCHEMBL6319090 0.84 SLC9A1 (0.62) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL20278459 0.83 MAPT (0.51) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL6314486 0.83 SLC9A1 (0.65) ALDH1A1RAB9AMAPTHPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030149043-A1 N-[(substituted five-membered di-or triaza diunsaturated ring)carbonyl] guanidine derivatives for the treatment of ischemia PFIZER INC. 2003-08-07 US claimed
EP-1056729-A1 N-[(SUBSTITUTED FIVE-MEMBERED DI- OR TRIAZA DIUNSATURATED RING)CARBONYL]GUANIDINE DERIVATIVES FOR THE TREATMENT OF ISCHEMIA Pfizer Products Inc. (US) 2000-12-06 EP claimed
WO-1999043663-A1 N-[(SUBSTITUTED FIVE-MEMBERED DI- OR TRIAZA DIUNSATURATED RING)CARBONYL] GUANIDINE DERIVATIVES FOR THE TREATMENT OF ISCHEMIA PFIZER PRODUCTS INC. (US) 1999-09-02 WO claimed
US-6974813-B2 N-[(substituted five-membered di-or triaza diunsaturated ring) carbonyl] guanidine derivatives for the treatment of ischemia WARNER-LAMBERT COMPANY (US) 2005-12-13 US disclosed
US-20030149043-A1 N-[(substituted five-membered di-or triaza diunsaturated ring)carbonyl] guanidine derivatives for the treatment of ischemia PFIZER INC. 2003-08-07 US disclosed
US-6492401-B1 SODIUM HYDROGEN EXCHANGER TYPE 1 INHIBITORS; REDUCING PERIOPERATIVE MYOCARDIAL TISSUE DAMAGE PFIZER, INC. 2002-12-10 US disclosed
EP-1056729-A1 N-[(SUBSTITUTED FIVE-MEMBERED DI- OR TRIAZA DIUNSATURATED RING)CARBONYL]GUANIDINE DERIVATIVES FOR THE TREATMENT OF ISCHEMIA Pfizer Products Inc. (US) 2000-12-06 EP disclosed
WO-1999043663-A1 N-[(SUBSTITUTED FIVE-MEMBERED DI- OR TRIAZA DIUNSATURATED RING)CARBONYL] GUANIDINE DERIVATIVES FOR THE TREATMENT OF ISCHEMIA PFIZER PRODUCTS INC. (US) 1999-09-02 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-20030149043-A1 N-[(substituted five-membered di-or triaza diunsaturated ring)carbonyl] guanidine derivatives for the treatment of ischemia NHERF1, SLC28A1, TNNI3 ALDH1A1 642/4885RAB9A 2117/4885MAPT 4418/4885

“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.