SCHEMBL6850341

SCHEMBL6850341

CC(C)[C@H](NC(=O)CNC(=O)CN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 8/20 0.40
▸ QRFPR Q96P65 1/20 0.39
▸ NPY4R P50391 7/20 0.36
▸ NPY1R P25929 5/20 0.36
▸ NPY5R Q15761 5/20 0.36
▸ NPY2R P49146 3/20 0.36
▸ TFPI P10646 1/20 0.35
▸ NOD1 Q9Y239 1/20 0.35
▸ PRSS1 P07477 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
SCHEMBL6850333 1.00 FURIN (0.40) FURINQRFPRNPY4RNPY1RNPY5R
SCHEMBL29485118 0.93 FURIN (0.40) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL30087255 0.92 FURIN (0.43) FURINQRFPRNPY4RNPY1RNPY5R
SCHEMBL24191073 0.91 C3AR1 (0.42) FURINQRFPRNOD1PRSS1
SCHEMBL31319761 0.90 C3AR1 (0.41) FURINQRFPRNOD1PRSS1
SCHEMBL30976568 0.89 FURIN (0.48) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL29355811 0.89 NPY4R (0.41) QRFPRNPY4RNPY1RNPY5RNPY2R
SCHEMBL30087281 0.88 NOD1 (0.44) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL30881182 0.88 TFPI (0.46) FURINQRFPRNPY4RNPY1RNPY5R
SCHEMBL3961412 0.87 QRFPR (0.46) QRFPRNPY4RNPY1RNPY5RNPY2R

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 — — US disclosed
WO-2001079195-A9 PYRIDINE AND PYRAZINE DERIVATIVES AS THROMBIN INHIBITORS CORVAS INT INC (US) 2003-10-23 — — WO disclosed
US-6541467-B1 And at P1 have a six-membered heterocyclic ring having two ring nitrogen ring atoms and the remainder of the ring atoms carbon atoms. CORVAS INTERNATIONAL, INC. 2003-04-01 — — US disclosed
US-6506754-B1 Compounds as anticoagulants CORVAS INTERNATIONAL, INC. 2003-01-14 — — US disclosed
US-6506761-B1 Compound of the invention are active as inhibitors of Thrombin and are useful in treating disease states in mammals which are characterized by abnormal thrombosis and have the following structure: CORVAS INTERNATIONAL, INC. 2003-01-14 — — US disclosed
US-6506760-B1 Compounds of the invention are active as inhibitors of Thrombin and are useful in treating disease states in mammals which are characterized by abnormal thrombosis and have the following structure: CORVAS INTERNATIONAL, INC. 2003-01-14 — — US disclosed
US-6342504-B1 PEPTIDES AS ANTITHROMBINS AND ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2002-01-29 — — US disclosed
WO-2001079195-A2 PYRIDINE AND PYRAZINE DERIVATIVES AS THROMBIN INHIBITORS CORVAS INTERNATIONAL, INC. (US) 2001-10-25 — — WO disclosed
WO-2001079193-A2 SUBSTITUTED HYDRAZINYL HETEROAROMATIC INHIBITORS OF THROMBIN CORVAS INTERNATIONAL, INC. (US) 2001-10-25 — — WO disclosed
WO-2001079262-A1 PYRAZINONE AND PYRIDINONE DERIVATIVES AS THROMBIN INHIBITORS CORVAS INTERNATIONAL, INC. (US) 2001-10-25 — — WO disclosed
WO-1995035313-A1 3-AMINO-2-OXO-1-PIPERIDINEACETIC DERIVATIVES CONTAINING AN ARGININE MIMIC AS ENZYME INHIBITORS CORVAS INTERNATIONAL, INC. (US) 1995-12-28 — — WO disclosed
WO-1995035312-A1 ARGININE MIMIC DERIVATIVES AS ENZYME INHIBITORS CORVAS INTERNATIONAL, INC. (US) 1995-12-28 — — WO disclosed
WO-1995035311-A1 3-AMINO-2-OXO-1-PIPERIDINEACETIC DERIVATIVES AS ENZYME INHIBITORS CORVAS INTERNATIONAL, INC. (US) 1995-12-28 — — WO disclosed
EP-0684830-A1 INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1995-12-06 — — EP disclosed
WO-1995028420-A1 METHIONINE SULFONE AND S-SUBSTITUTED CYSTEINE SULFONE DERIVATIVES AS ENZYME INHIBITORS CORVAS INTERNATIONAL, INC. (US) 1995-10-26 — — WO disclosed
EP-0627929-A4 INHIBITORS OF THROMBOSIS. CORVAS INT INC (US) 1995-07-12 — — EP disclosed
EP-0627929-A1 INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1994-12-14 — — EP disclosed
WO-1994021673-A1 ALPHA-KETOAMIDE DERIVATIVES AS INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1994-09-29 — — WO disclosed
WO-1994017817-A1 INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1994-08-18 — — WO disclosed
WO-1993015756-A1 INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1993-08-19 — — WO disclosed
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