SCHEMBL18716889

SCHEMBL18716889

CNCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NC(Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(CCC=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 6/20 0.53
▸ KISS1R Q969F8 6/20 0.49
▸ CTSL P07711 2/20 0.46
▸ CTSS P25774 2/20 0.46
▸ CTSK P43235 2/20 0.46
▸ CTSH P09668 1/20 0.46
▸ C5AR1 P21730 1/20 0.46
▸ IL23R Q5VWK5 2/20 0.45
▸ NPFFR1 Q9GZQ6 1/20 0.45
▸ TUBB4A P04350 1/20 0.45
▸ TUBB P07437 1/20 0.45
▸ TUBA3C P0DPH7 1/20 0.45
▸ TUBA1B P68363 1/20 0.45
▸ TUBA4A P68366 1/20 0.45
▸ TUBB4B P68371 1/20 0.45
▸ TUBB3 Q13509 1/20 0.45
▸ TUBB2A Q13885 1/20 0.45
▸ TUBB8 Q3ZCM7 1/20 0.45
▸ TUBA3E Q6PEY2 1/20 0.45
▸ TUBA1A Q71U36 1/20 0.45

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
SCHEMBL23750071 0.92 MC4R (0.56) MC4RKISS1RC5AR1IL23R
SCHEMBL19473852 0.90 KISS1R (0.56) MC4RKISS1RIL23RNPFFR1
SCHEMBL12057583 0.89 MC4R (0.64) MC4RKISS1RCTSLCTSSCTSK
SCHEMBL29420167 0.89 MC4R (0.64) MC4RKISS1RCTSLCTSSCTSK
SCHEMBL18717210 0.88 MC4R (0.55) MC4RKISS1RIL23R
SCHEMBL14523926 0.88 MC4R (0.51) MC4RKISS1RC5AR1IL23RNPFFR1
SCHEMBL18717198 0.87 MC4R (0.53) MC4RKISS1RCTSLCTSSCTSK
SCHEMBL12094776 0.86 MC4R (0.54) MC4RKISS1RCTSLCTSSCTSK
SCHEMBL29862201 0.86 KISS1R (0.55) MC4RKISS1RCTSLCTSSCTSK
SCHEMBL29862214 0.86 KISS1R (0.54) MC4RKISS1RCTSLCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440572-B1 LACTAM-BRIDGED MELANOCORTIN RECEPTOR-SPECIFIC PEPTIDES PALATIN TECHNOLOGIES INC (US) 2017-04-05 — — EP disclosed
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