SCHEMBL3839191

SCHEMBL3839191

CN1CCN(Cc2cccc([C]=O)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.60
MC4R P32245 1/20 0.57
CHKA P35790 4/20 0.48
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
RAB9A P51151 1/20 0.48
LMNA P02545 1/20 0.46
CA2 P00918 1/20 0.45
NCF1 P14598 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
SIGMAR1 Q99720 2/20 0.45
ACHE P22303 1/20 0.45
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44

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
SCHEMBL14661526 0.84 HRH3 (0.60) HRH3MC4RCHKANPC1TP53
SCHEMBL14661636 0.84 HRH3 (0.60) HRH3MC4RCHKANPC1TP53
SCHEMBL1482500 0.84 HRH3 (0.60) HRH3MC4RCHKAFAAH
SCHEMBL29809149 0.84 HRH3 (0.60) HRH3MC4RCHKAFAAH
SCHEMBL31721210 0.84 HRH3 (0.60) HRH3MC4RCHKANPC1TP53
SCHEMBL18945566 0.83 HRH3 (0.66) HRH3MC4RCHKANPC1TP53
SCHEMBL13535291 0.83 MC4R (0.74) HRH3MC4RCHKANPC1TP53
SCHEMBL6409204 0.81 NCF1 (0.60) HRH3NPC1TP53RAB9ACA2
SCHEMBL2324448 0.81 SIGMAR1 (0.57) HRH3SIGMAR1FAAH
SCHEMBL1978437 0.80 LMNA (0.61) HRH3MC4RCHKANPC1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1858898-B1 HYDRAZINOCARBONYL-THIENO[2,3-C]PYRAZOLES, PREPARATION METHOD, COMPOSITIONS CONTAINING SAME AND USE AVENTIS PHARMA SA (FR) 2009-08-26 EP disclosed
EP-1858898-A1 HYDRAZINOCARBONYL-THIENO[2,3-C]PYRAZOLES, PREPARATION METHOD, COMPOSITIONS CONTAINING SAME AND USE Aventis Pharma S.A. (FR) 2007-11-28 EP disclosed
WO-2006092510-A1 HYDRAZINOCARBONYL-THIENO[2,3-C]PYRAZOLES, PREPARATION METHOD, COMPOSITIONS CONTAINING SAME AND USE AVENTIS PHARMA S.A. (FR) 2006-09-08 WO disclosed
US-20050222098-A1 Regulation of meiosis NOVO NORDISK A/S (DK) 2005-10-06 US disclosed
EP-0767798-B1 STEROL DERIVATIVES USED FOR REGULATION OF MEIOSIS NOVO NORDISK AS (DK) 2003-09-03 EP disclosed
US-20030004148-A1 Regulation of meiosis NOVO NORDISK A/S (DK) 2003-01-02 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 (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-20050222098-A1 Regulation of meiosis ALPG, MNS1, BUB1B HRH3 3595/4885MC4R 4207/4885CHKA 1903/4885
US-20030004148-A1 Regulation of meiosis ALPG, MNS1, BUB1B HRH3 3595/4885MC4R 4207/4885CHKA 1903/4885

“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.