SCHEMBL9886166

SCHEMBL9886166

Cc1ccc(C2=NOC(C)CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 7/20 0.42
▸ MEN1 O00255 1/20 0.38
▸ MAPK10 P53779 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NISCH Q9Y2I1 1/20 0.35
▸ RAB9A P51151 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ HRH2 P25021 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL15275698 0.84 NPC1 (0.43) MAOBKMT2ARAB9AALDH1A1NPC1
SCHEMBL15275699 0.84 CA1 (0.41) MAOBRAB9AALDH1A1NPC1GAA
SCHEMBL8578279 0.81 MAOB (0.51) MAOBMEN1MAPK10KMT2AALDH1A1
SCHEMBL27901151 0.72 NOS3 (0.39) MAOBNISCHRAB9AALDH1A1NPC1
SCHEMBL30594257 0.69 MAOB (0.39) MAOBMEN1KMT2ANISCHRAB9A
SCHEMBL24363868 0.69 NISCH (0.43) MAOBMEN1KMT2ANISCHRAB9A
SCHEMBL8578277 0.69 MAOB (0.50) MAOBMEN1MAPK10KMT2AALDH1A1
SCHEMBL14214318 0.69 MAOB (0.50) MAOBMEN1MAPK10KMT2AALDH1A1
SCHEMBL25323171 0.69 NISCH (0.43) MAOBMEN1KMT2ANISCHRAB9A
SCHEMBL8243017 0.68 MIF (0.52) MAOBRAB9ANPC1

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-9212348-B2 Method for producing hematopoietic stem cells using pyrazole compounds NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-15 — — US disclosed
US-9212348-B2 Method for producing hematopoietic stem cells using pyrazole compounds NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-15 — — US disclosed
US-20140057353-A1 METHOD FOR PRODUCING HEMATOPOIETIC STEM CELLS USING PYRAZOLE COMPOUNDS REPROCELL INCORPORATED (JP) 2014-02-27 — — US disclosed
US-20140057353-A1 METHOD FOR PRODUCING HEMATOPOIETIC STEM CELLS USING PYRAZOLE COMPOUNDS REPROCELL INCORPORATED (JP) 2014-02-27 — — US disclosed
US-8658686-B2 Pyrazole compounds having therapeutic effect on multiple myeloma NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-02-25 — — US disclosed
US-8658686-B2 Pyrazole compounds having therapeutic effect on multiple myeloma NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-02-25 — — US disclosed
US-20130253204-A1 PYRAZOLE COMPOUNDS HAVING THERAPEUTIC EFFECT ON MULTIPLE MYELOMA NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-09-26 — — US disclosed
US-20130253204-A1 PYRAZOLE COMPOUNDS HAVING THERAPEUTIC EFFECT ON MULTIPLE MYELOMA NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-09-26 — — US disclosed
WO-2012074067-A1 PYRAZOLE COMPOUND HAVING THERAPEUTIC EFFECT ON MULTIPLE MYELOMA 日産化学工業株式会社 (JP) 2012-06-07 — — WO disclosed
WO-2012074068-A1 METHOD FOR PRODUCING HEMATOPOIETIC STEM CELLS USING PYRAZOLE COMPOUND 日産化学工業株式会社 (JP) 2012-06-07 — — 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 (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-20130253204-A1 PYRAZOLE COMPOUNDS HAVING THERAPEUTIC EFFECT ON MULTIPLE MYELOMA MCL1, BCL6, RTN3 MAOB 4791/4885MEN1 377/4885MAPK10 1708/4885
US-20140057353-A1 METHOD FOR PRODUCING HEMATOPOIETIC STEM CELLS USING PYRAZOLE COMPOUNDS HCLS1, RUNX1, HPRT1 MAOB 4031/4885MEN1 2920/4885MAPK10 4815/4885

“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.

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