SCHEMBL16694846

SCHEMBL16694846

Nc1cncc(Br)c1N1CCC(NC(=O)O)CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.39
▸ SMYD3 Q9H7B4 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.35
▸ PAK1 Q13153 2/20 0.35
▸ OPRK1 P41145 1/20 0.34
▸ CKS1B P61024 2/20 0.34
▸ SKP1 P63208 2/20 0.34
▸ SKP2 Q13309 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ SSTR2 P30874 2/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ CYP46A1 Q9Y6A2 1/20 0.33
▸ GRIN2B Q13224 1/20 0.33

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
SCHEMBL17965887 0.81 POLB (0.38) SIGMAR1OPRK1POLB
SCHEMBL16504982 0.80 AKT1 (0.41) CYP3A4
SCHEMBL16694764 0.79 SSTR2 (0.57) SSTR2KCNH2
SCHEMBL26632104 0.79 AURKA (0.31) SMYD3
SCHEMBL31302385 0.78 CCNC (0.39) —
SCHEMBL31302406 0.78 CYP3A4 (0.48) CYP3A4
SCHEMBL30255015 0.78 KDM4E (0.37) SIGMAR1PAK1OPRK1CKS1BSKP1
SCHEMBL21248811 0.76 SMPD3 (0.35) OPRK1
SCHEMBL21248810 0.76 SMPD3 (0.35) OPRK1
SCHEMBL15778914 0.76 CYP46A1 (0.48) SIGMAR1POLBCYP46A1

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
US-20180194775-A1 COMPOUND HAVING AGONISTIC ACTIVITY ON SOMATOSTATIN RECEPTOR, AND USE THEREOF FOR MEDICAL PURPOSES ONO PHARMACEUTICAL CO., LTD. (JP) 2018-07-12 — — US disclosed
US-9975904-B2 Compound having agonistic activity on somatostatin receptor, and use thereof for medical purposes ONO PHARMACEUTICAL CO., LTD. (JP) 2018-05-22 — — US disclosed
US-20170183359-A1 COMPOUND HAVING AGONISTIC ACTIVITY ON SOMATOSTATIN RECEPTOR, AND USE THEREOF FOR MEDICAL PURPOSES ONO PHARMACEUTICAL CO., LTD. (JP) 2017-06-29 — — US disclosed
US-9630976-B2 Compound having agonistic activity on somatostatin receptor, and use thereof for medical purposes ONO PHARMACEUTICAL CO., LTD. (JP) 2017-04-25 — — US disclosed
US-20150232478-A1 COMPOUND HAVING AGONISTIC ACTIVITY ON SOMATOSTATIN RECEPTOR, AND USE THEREOF FOR MEDICAL PURPOSES ONO PHARMACEUTICAL CO., LTD. (JP) 2015-08-20 — — US disclosed
EP-2871179-A1 COMPOUND HAVING AGONISTIC ACTIVITY ON SOMATOSTATIN RECEPTOR, AND USE THEREOF FOR MEDICAL PURPOSES ONO Pharmaceutical Co., Ltd. (JP) 2015-05-13 — — 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 (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-20170183359-A1 COMPOUND HAVING AGONISTIC ACTIVITY ON SOMATOSTATIN RECEPTOR, AND USE THEREOF FOR MEDICAL PURPOSES SSTR2, SSTR1, SSTR3 CYP3A4 2401/4885SMYD3 3010/4885SIGMAR1 81/4885
US-20150232478-A1 COMPOUND HAVING AGONISTIC ACTIVITY ON SOMATOSTATIN RECEPTOR, AND USE THEREOF FOR MEDICAL PURPOSES SSTR2, SSTR1, SSTR3 CYP3A4 2551/4885SMYD3 3267/4885SIGMAR1 94/4885
US-20180194775-A1 COMPOUND HAVING AGONISTIC ACTIVITY ON SOMATOSTATIN RECEPTOR, AND USE THEREOF FOR MEDICAL PURPOSES SSTR2, SSTR1, SSTR3 CYP3A4 2401/4885SMYD3 3010/4885SIGMAR1 81/4885

“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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