SCHEMBL6175340

SCHEMBL6175340

CCCCCC[N]C(C)C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
THRB P10828 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NAAA Q02083 1/20 0.42
ALDH1A1 P00352 2/20 0.41
DNM1 Q05193 6/20 0.38
OPRM1 P35372 1/20 0.36
TRPM8 Q7Z2W7 4/20 0.36
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL269743 0.88
SCHEMBL4510709 0.79 MEN1 (0.44) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL6176135 0.79 TSHR (0.40) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL4512993 0.79 MEN1 (0.44) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL9205665 0.77 OPRM1 (0.42) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL9205449 0.77 DNM1 (0.44) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL9209437 0.77 OPRM1 (0.42) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL9203784 0.77 OPRM1 (0.42) TSHRTHRBMEN1KMT2ANAAA
SCHEMBL4522986 0.76
SCHEMBL6177787 0.76 NAAA (0.36) TSHRTHRBMEN1KMT2ANAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3835367-A1 ADDITIVE COMPOSITION, FLAME-RETARDANT SYNTHETIC RESIN COMPOSITION CONTAINING SAME, AND MOLDED ARTICLE THEREOF ADEKA CORPORATION (JP) 2021-06-16 EP disclosed
CN-112368339-A Additive composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2021-02-12 CN disclosed
WO-2020032210-A1 ADDITIVE COMPOSITION, FLAME-RETARDANT SYNTHETIC RESIN COMPOSITION CONTAINING SAME, AND MOLDED ARTICLE THEREOF 株式会社ADEKA 2020-02-13 WO disclosed
EP-0945445-B9 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARM CO LTD (JP) 2005-12-28 EP disclosed
US-20050148634-A1 1-N-Aminobenzimidazole derivatives ZERIA PHARMACEUTICAL CO., LTD (JP) 2005-07-07 US disclosed
EP-0945445-B1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARM CO LTD (JP) 2003-09-03 EP disclosed
US-6239131-B1 WHICH HAVE GASTRIN AND/OR CCK-B (CHOLECYSTOKININ-B) RECEPTOR ANTAGONISM, USEFUL AS REMEDIES FOR GASTRIC ULCER AND GASTROINTESTINAL MOVEMENT DISORDER. ZERIA PHARMACEUTICAL CO., LTD. (JP) 2001-05-29 US disclosed
EP-0945445-A1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed
EP-0641207-A4 ENANTIOMERIC CYNEMICIN ANALOGS, PREPARATION AND USE THEREOF. SCRIPPS RESEARCH INST (US) 1996-08-14 EP disclosed
US-5527805-A DNA-CLEAVING, CYTOTOXIC AND ANTI-TUMOR COMPOUNDS THE SCRIPPS RESEARCH INSTITUTE (US) 1996-06-18 US disclosed
US-H1487-H Antitumor agents; treatment of ovarian, breast and other cancers BRISTOL-MYERS SQUIBB COMPANY (US) 1995-09-05 US disclosed
EP-0641207-A1 ENANTIOMERIC CYNEMICIN ANALOGS, PREPARATION AND USE THEREOF THE SCRIPPS RESEARCH INSTITUTE (US) 1995-03-08 EP disclosed
US-5281710-A Antibiotics or antitumor agents THE SCRIPPS RESEARCH INSTITUTE (US) 1994-01-25 US disclosed
US-5276159-A Antitumor THE SCRIPPS RESEARCH INSTITUTE (US) 1994-01-04 US disclosed
WO-1993023046-A1 ENANTIOMERIC CYNEMICIN ANALOGS, PREPARATION AND USE THEREOF THE SCRIPPS RESEARCH INSTITUTE (US) 1993-11-25 WO disclosed
EP-0569281-A1 Benzoate derivatives of taxol Bristol-Myers Squibb Company (US) 1993-11-10 EP 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 (1 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-20050148634-A1 1-N-Aminobenzimidazole derivatives CYP1B1, CYP2E1, CYP1A1 TSHR 3190/4885THRB 1921/4885MEN1 4155/4885

“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.