SCHEMBL6406480

SCHEMBL6406480

CN(C)Cc1cccc([C]=O)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ NOS1 P29475 1/20 0.45
▸ HTR7 P34969 2/20 0.41
▸ CHRNB2 P17787 1/20 0.40
▸ CHRNA4 P43681 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.39
▸ MEP1A Q16819 1/20 0.39
▸ MEP1B Q16820 1/20 0.39
▸ TAAR1 Q96RJ0 2/20 0.39
▸ PTGES O14684 3/20 0.38
▸ ACHE P22303 2/20 0.38
▸ ATP4A P20648 1/20 0.37
▸ ATP4B P51164 1/20 0.37
▸ PYCR1 P32322 2/20 0.37

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
SCHEMBL6406759 0.81 CYP1A2 (0.45) TSHRHRH3MEP1AMEP1BPTGES
SCHEMBL31721197 0.81 TSHR (0.48) ALDH1A1TSHRNOS1HTR7CHRNB2
SCHEMBL153971 0.81 MEP1A (0.53) ALDH1A1TSHRNOS1HTR7HRH3
SCHEMBL6405789 0.80 TSHR (0.48) TSHRHRH3MEP1AMEP1BPTGES
SCHEMBL989636 0.79 ALDH1A1 (0.67) ALDH1A1TSHRNOS1HTR7CHRNB2
SCHEMBL910601 0.78 MGLL (0.43) ALDH1A1
SCHEMBL7423782 0.78 TRPA1 (0.42) ALDH1A1TSHRMEP1AMEP1BPTGES
SCHEMBL6410635 0.75 HRH3 (0.56) ALDH1A1TSHRNOS1CHRNB2CHRNA4
SCHEMBL910177 0.74 DRD2 (0.40) PTGES
SCHEMBL5158276 0.74 TSHR (0.46) TSHRHRH3MEP1AMEP1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 — — US claimed
EP-1001943-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM Aventis Pharma S.A. (FR) 2000-05-24 — — EP claimed
WO-1999003843-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-01-28 — — WO claimed
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
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 — — US disclosed
CN-1068333-C Sterol derivatives used for regulation of meiosis NOVO NORDISK AS (DK) 2001-07-11 — — CN disclosed
EP-1001943-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM Aventis Pharma S.A. (FR) 2000-05-24 — — EP disclosed
WO-1999003843-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-01-28 — — WO disclosed
WO-1998008492-A1 TRANSDERMAL DELIVERY OF PEPTIDES NOVO NORDISK A/S (DK) 1998-03-05 — — WO disclosed
CN-1151164-A Sterol derivatives used for regulation of meiosis NOVO NORDISK AS (DK) 1997-06-04 — — CN disclosed
EP-0767798-A1 STEROL DERIVATIVES USED FOR REGULATION OF MEIOSIS NOVO NORDISK A/S (DK) 1997-04-16 — — EP disclosed
WO-1996000235-A1 STEROL DERIVATIVES USED FOR REGULATION OF MEIOSIS NOVO NORDISK A/S (DK) 1996-01-04 — — 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-20050222098-A1 Regulation of meiosis ALPG, MNS1, BUB1B ALDH1A1 2659/4885TSHR 4376/4885NOS1 4284/4885
US-20030004148-A1 Regulation of meiosis ALPG, MNS1, BUB1B ALDH1A1 2659/4885TSHR 4376/4885NOS1 4284/4885

“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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