SCHEMBL763148

SCHEMBL763148

CN1CC(=O)N2[C@@H](CO)C(=O)N(Cc3ccccc3)C[C@@H]2N1C(=O)NCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CLPP Q16740 4/20 0.47
▸ CYP3A4 P08684 14/20 0.46
▸ CACNA1G O43497 1/20 0.46
▸ CACNA1H O95180 1/20 0.46
▸ CACNA1I Q9P0X4 1/20 0.46
▸ CTNNB1 P35222 2/20 0.44
▸ TCF7 P36402 2/20 0.44
▸ BCL9 O00512 1/20 0.44
▸ TCF4 P15884 1/20 0.44
▸ CREBBP Q92793 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
SCHEMBL747322 0.92 CLPP (0.56) CLPPCYP3A4CTNNB1TCF7BCL9
SCHEMBL744658 0.91 CLPP (0.47) CLPPCYP3A4CACNA1GCACNA1HCACNA1I
SCHEMBL747398 0.91 CLPP (0.48) CLPPCYP3A4CACNA1GCACNA1HCACNA1I
SCHEMBL747407 0.90 CLPP (0.47) CLPPCYP3A4CACNA1GCACNA1HCACNA1I
SCHEMBL745477 0.90 CLPP (0.59) CLPPCYP3A4CACNA1GCACNA1HCACNA1I
SCHEMBL10291351 0.90 CLPP (0.46) CLPPCYP3A4CACNA1GCACNA1HCACNA1I
SCHEMBL747397 0.89 SIRT5 (0.49) CLPPCYP3A4CACNA1GCACNA1HCACNA1I
SCHEMBL745495 0.88 CLPP (0.60) CLPPCYP3A4
SCHEMBL762431 0.88 CLPP (0.46) CLPPCYP3A4CACNA1GCACNA1HCACNA1I
SCHEMBL747509 0.88 CYP3A4 (0.53) CLPPCYP3A4CTNNB1TCF7BCL9

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-8138337-B2 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2012-03-20 — — US disclosed
US-8049008-B2 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2011-11-01 — — US disclosed
US-7932384-B2 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2011-04-26 — — US disclosed
US-20100222303-A1 REVERSE-TURN MIMETICS AND METHOD RELATING THERETO CHOONGWAE PHARMA CORPORATION (KR) 2010-09-02 — — US disclosed
US-7671054-B1 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2010-03-02 — — US disclosed
US-7671054-B1 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2010-03-02 — — US disclosed
US-20100029630-A1 REVERSE-TURN MIMETICS AND METHOD RELATING THERETO Chongwae Pharma Corporation (KR) 2010-02-04 — — US disclosed
US-7566711-B2 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2009-07-28 — — US disclosed
US-7566711-B2 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2009-07-28 — — US disclosed
US-20070043052-A1 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2007-02-22 — — 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 (3 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-20100222303-A1 REVERSE-TURN MIMETICS AND METHOD RELATING THERETO WNT1, WNT3, APC CLPP 4145/4885CYP3A4 3595/4885CACNA1G 4588/4885
US-20100029630-A1 REVERSE-TURN MIMETICS AND METHOD RELATING THERETO WNT1, APC, WNT3 CLPP 4096/4885CYP3A4 4757/4885CACNA1G 4620/4885
US-20070043052-A1 Reverse-turn mimetics and method relating thereto WNT1, APC, WNT3 CLPP 4096/4885CYP3A4 4757/4885CACNA1G 4620/4885

“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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