SCHEMBL741062

SCHEMBL741062

CN1CCN2CC1C2c1ccc(-c2[c]ccc(CN3CCCC3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.35
HRH4 Q9H3N8 1/20 0.34
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
MBTD1 Q05BQ5 1/20 0.33
TP53BP1 Q12888 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CHKA P35790 2/20 0.33
BRD4 O60885 1/20 0.32
CCL2 P13500 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
NCF1 P14598 1/20 0.32
TMEM97 Q5BJF2 1/20 0.31
PRMT6 Q96LA8 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL742675 0.70
SCHEMBL9952370 0.69 ALDH1A1 (0.44) HRH3HRH4CHKA
SCHEMBL6305207 0.60 SMN1; SMN2 (0.57) HRH3HRH4CYP2D6CYP2C19PRMT6
SCHEMBL738784 0.60 HRH3 (0.67) HRH3HRH4MBTD1L3MBTL3L3MBTL1
SCHEMBL2443671 0.59 MBTD1 (0.40) HRH3DRD2MBTD1TP53BP1L3MBTL3
SCHEMBL1662326 0.58 ALDH1A1 (0.50) HRH3HRH4CHKAPRMT6POLB
SCHEMBL447560 0.58 HRH3 (0.71) HRH3HRH4MBTD1L3MBTL3L3MBTL1
SCHEMBL996532 0.58 HRH3 (0.71) HRH3HRH4MBTD1L3MBTL3L3MBTL1
SCHEMBL5553943 0.58 HRH3 (0.57) HRH3HRH4CHKACYP2D6CYP2C19
SCHEMBL28282914 0.57 HRH3 (0.68) HRH3HRH4MBTD1L3MBTL3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481584-B2 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-07-09 US disclosed
US-20120165311-A1 1H-THIENO[2,3-C]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-06-28 US disclosed
US-8138217-B2 Aurora kinase inhibitors; proliferative disorders; anticancer agents; antitumor agents; N-(1-methyl-1-phenylethyl)-3-((4-morpholin-4-ylbenzoyl)amino)-1H-thieno(2,3-c)pyrazole-5-carboxamide NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-03-20 US disclosed
EP-1711177-B1 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS PFIZER ITALIA SRL (IT) 2008-05-28 EP disclosed
EP-1711177-A1 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS Pfizer Italia S.r.l. (IT) 2006-10-18 EP disclosed
US-20050187209-A1 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors PHARMACIA ITALIA S.P.A. (IT) 2005-08-25 US disclosed
WO-2005074922-A1 1H-THIENO[2,3-c]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS PFIZER ITALIA S.R.L. (IT) 2005-08-18 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-20120165311-A1 1H-THIENO[2,3-C]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS MAP3K19, MAP3K1, MAP3K3 HRH3 3351/4885HRH4 3242/4885DRD2 4651/4885
US-20050187209-A1 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors MAP3K19, MAP3K1, MAP3K3 HRH3 3400/4885HRH4 3251/4885DRD2 4658/4885

“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.