SCHEMBL29601531

SCHEMBL29601531

CC(C)C(NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)c1ccc(C(=O)NCC(=O)[O-])cc1)C(C)C)C(=O)C(F)(F)F.[Na+]

nearest known ligand 0.63

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 19/20 0.63
CTSG P08311 1/20 0.63
CMA1 P23946 1/20 0.51

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
SCHEMBL3935567 0.91 ELANE (0.67) ELANECTSGCMA1
SCHEMBL20943188 0.91 ELANE (0.67) ELANECTSGCMA1
SCHEMBL3935563 0.91 ELANE (0.67) ELANECTSGCMA1
SCHEMBL20943154 0.91 ELANE (0.67) ELANECTSGCMA1
SCHEMBL30583172 0.91 ELANE (0.67) ELANECTSGCMA1
SCHEMBL17378380 0.86 ELANE (0.68) ELANECTSGCMA1
SCHEMBL7310675 0.86 ELANE (0.80) ELANECTSGCMA1
SCHEMBL18880036 0.86 ELANE (0.68) ELANECTSGCMA1
SCHEMBL20943178 0.86 ELANE (0.65) ELANECTSGCMA1
SCHEMBL8251369 0.86 ELANE (0.71) ELANECTSGCMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4004548-B1 METHODS OF TREATING AND DIAGNOSING LUNG CANCER YEDA RES & DEV (IL) 2026-01-14 EP disclosed
US-20250354993-A1 METHODS OF TREATING AND DIAGNOSING LUNG CANCER YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2025-11-20 US disclosed
US-11376312-B2 Composition and method for treating nucleic acid-related eye disease THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2022-07-05 US disclosed
EP-4004548-A1 METHODS OF TREATING AND DIAGNOSING LUNG CANCER Yeda Research and Development Co. Ltd (IL) 2022-06-01 EP disclosed
US-20220155305-A1 METHODS OF TREATING AND DIAGNOSING LUNG CANCER YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2022-05-19 US disclosed