SCHEMBL509136

SCHEMBL509136

[CH2]CNC(=O)c1cnccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.61
KDM4E B2RXH2 3/20 0.58
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
ALDH1A1 P00352 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
CYP1A2 P05177 2/20 0.56
HPGD P15428 2/20 0.56
CYP2C19 P33261 2/20 0.56
CYP2C9 P11712 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
CYP3A4 P08684 1/20 0.54
LMNA P02545 1/20 0.54
RAB9A P51151 2/20 0.52
NAPRT Q6XQN6 1/20 0.52
HCAR2 Q8TDS4 1/20 0.52
NPC1 O15118 1/20 0.50
ALOX15 P16050 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
TSHR P16473 1/20 0.50

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
SCHEMBL7214784 0.82 KDM4E (0.71) SMN1; SMN2KDM4EKMT2AMEN1ALDH1A1
SCHEMBL28092442 0.81 SMN1; SMN2 (0.61) SMN1; SMN2KDM4EKMT2AMEN1ALDH1A1
SCHEMBL2215871 0.81 KDM4E (0.67) SMN1; SMN2KDM4EKMT2AMEN1ALDH1A1
SCHEMBL10668907 0.81 SMN1; SMN2 (0.61) SMN1; SMN2KDM4EKMT2AMEN1ALDH1A1
SCHEMBL10671618 0.81 SMN1; SMN2 (0.61) SMN1; SMN2KDM4EKMT2AMEN1ALDH1A1
SCHEMBL10674362 0.81 KDM4E (0.67) SMN1; SMN2KDM4EKMT2AMEN1CYP1A2
SCHEMBL10669690 0.81 SMN1; SMN2 (0.56) SMN1; SMN2KDM4EKMT2AMEN1ALDH1A1
SCHEMBL4453572 0.80 SMN1; SMN2 (0.59) SMN1; SMN2KDM4EKMT2AMEN1ALDH1A1
SCHEMBL733049 0.79 KDM4E (0.63) SMN1; SMN2KDM4EKMT2AMEN1CYP1A2
SCHEMBL1428913 0.79 KDM4E (0.63) SMN1; SMN2KDM4EKMT2AMEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137187-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE Inovacia AB (SE) 2009-12-30 EP claimed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US claimed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 WO claimed
EP-1762567-B1 Pyrazole derivatives for treating HIV PFIZER LTD (GB) 2012-05-02 EP disclosed
US-20120029192-A1 Pyrazole Derivatives PFIZER INC 2012-02-02 US disclosed
US-8063044-B2 Pyrazole derivatives PFIZER INC. (US) 2011-11-22 US disclosed
EP-2137187-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE Inovacia AB (SE) 2009-12-30 EP disclosed
US-20090215712-A1 PYRAZOLE DERIVATIVES PFIZER INC 2009-08-27 US disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
US-7435728-B2 Pyrazole derivatives PFIZER INC (US) 2008-10-14 US disclosed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 WO disclosed
EP-1377556-B1 PYRAZOLE DERIVATIVES FOR TREATING HIV PFIZER LTD (GB) 2007-04-04 EP disclosed
EP-1762567-A1 Pyrazole derivatives for treating HIV Pfizer Limited (GB) 2007-03-14 EP disclosed
US-7109228-B2 Pyrazole derivatives AGOURON PHARMACEUTICALS, INC. (US) 2006-09-19 US disclosed
US-20060020012-A1 Pyrazole derivatives PFIZER INC 2006-01-26 US disclosed
EP-1377556-A1 PYRAZOLE DERIVATIVES FOR TREATING HIV Pfizer Limited (GB) 2004-01-07 EP disclosed
US-20030100554-A1 Pyrazole derivatives JONES LYN HOWARD (GB) 2003-05-29 US disclosed
WO-2002085860-A1 PYRAZOLE DERIVATIVES FOR TREATING HIV PFIZER LIMITED (GB) 2002-10-31 WO disclosed
US-6071910-A Use of agents to treat eosinophil-associated pathologies MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2000-06-06 US disclosed
US-4007201-A ANTIDIABETIC KYORIN PHARMACEUTICAL CO. LTD. (JA) 1977-02-08 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 (5 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-20090215712-A1 PYRAZOLE DERIVATIVES RRM2B, REV1, RRM2 SMN1; SMN2 3225/4885KDM4E 1500/4885KMT2A 2507/4885
US-20060020012-A1 Pyrazole derivatives PDCD11, RTF1, REV1 SMN1; SMN2 3577/4885KDM4E 1943/4885KMT2A 3169/4885
US-20120029192-A1 Pyrazole Derivatives POLRMT, PDCD11, DPYD SMN1; SMN2 3432/4885KDM4E 2614/4885KMT2A 3500/4885
US-20080255153-A1 New compounds SCD, SCD5, FADS2 SMN1; SMN2 987/4885KDM4E 1192/4885KMT2A 3754/4885
US-20030100554-A1 Pyrazole derivatives REV1, SARS1, CYP2F1 SMN1; SMN2 2943/4885KDM4E 2816/4885KMT2A 3782/4885

“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.