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SCHEMBL30946722

SCHEMBL30946722

CC[C@H](C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CN)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(C)=O)[C@@H](C)CC)[C@@H](C)CC

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTH1R Q03431 9/20 0.66
▸ CXCR4 P61073 2/20 0.65
▸ GRPR P30550 1/20 0.63
▸ GLP1R P43220 5/20 0.63
▸ RXFP1 Q9HBX9 1/20 0.63
▸ ECE1 P42892 1/20 0.61
▸ MUS81 Q96NY9 1/20 0.61
▸ CCKBR P32239 1/20 0.61
▸ NR3C1 P04150 2/20 0.60

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
SCHEMBL30008333 0.97 PTH1R (0.66) PTH1RCXCR4GRPRGLP1RRXFP1
SCHEMBL29774757 0.93 GRPR (0.66) PTH1RCXCR4GRPRGLP1RRXFP1
SCHEMBL30408986 0.92 PTH1R (0.67) PTH1RCXCR4GRPRGLP1RRXFP1
SCHEMBL29412274 0.91 GLP1R (0.73) PTH1RGRPRGLP1RRXFP1ECE1
SCHEMBL31140800 0.87 GLP1R (0.70) PTH1RGLP1RRXFP1ECE1MUS81
SCHEMBL29736869 0.87 NR3C1 (0.72) GRPRGLP1RECE1MUS81CCKBR
SCHEMBL30744286 0.87 NR3C1 (0.71) PTH1RGRPRGLP1RRXFP1ECE1
SCHEMBL29736864 0.86 NR3C1 (0.72) GLP1RECE1MUS81CCKBRNR3C1
SCHEMBL30744278 0.86 GRPR (0.69) PTH1RCXCR4GRPRGLP1RRXFP1
SCHEMBL29491080 0.86 NR3C1 (0.76) GLP1RECE1MUS81CCKBRNR3C1

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-4622651-A1 INHIBITORY NUCLEIC ACIDS AND METHODS OF USE THEREOF The Regents of the University of California (US) 2025-10-01 — — EP claimed
WO-2024112653-A1 INHIBITORY NUCLEIC ACIDS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-05-30 — — WO claimed
EP-4622651-A1 INHIBITORY NUCLEIC ACIDS AND METHODS OF USE THEREOF The Regents of the University of California (US) 2025-10-01 — — EP disclosed
WO-2024257512-A1 RELAY NECESSITY DETERMINATION DEVICE AND RELAY NECESSITY DETERMINATION METHOD 株式会社日立製作所 2024-12-19 — — WO disclosed
WO-2024112653-A1 INHIBITORY NUCLEIC ACIDS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-05-30 — — WO disclosed
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