SCHEMBL30740807

SCHEMBL30740807

Cc1ccc(Oc2cccc(C(=O)O)c2)c(Cl)c1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 5/20 0.74
▸ KMO O15229 1/20 0.58
▸ AKR1C3 P42330 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ IDO1 P14902 1/20 0.50
▸ TTR P02766 4/20 0.48
▸ NPC1 O15118 1/20 0.47
▸ NR4A2 P43354 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ PPARG P37231 2/20 0.46
▸ KMT2A Q03164 1/20 0.46

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
SCHEMBL29103540 1.00 MRGPRX4 (0.74) MRGPRX4KMOAKR1C3ALDH1A1MAPT
SCHEMBL15011479 0.89 MRGPRX4 (0.66) MRGPRX4KMOAKR1C3ALDH1A1MAPT
SCHEMBL31568461 0.85 MRGPRX4 (1.00) MRGPRX4KMOAKR1C3ALDH1A1MAPT
SCHEMBL9005664 0.85 MRGPRX4 (0.60) MRGPRX4KMOAKR1C3IDO1TTR
SCHEMBL10668436 0.85 MRGPRX4 (1.00) MRGPRX4KMOAKR1C3ALDH1A1MAPT
SCHEMBL27108465 0.83 MRGPRX4 (0.62) MRGPRX4KMOAKR1C3TTRRAB9A
SCHEMBL10674162 0.83 MRGPRX4 (0.74) MRGPRX4KMOAKR1C3ALDH1A1MAPT
SCHEMBL11151654 0.82 MRGPRX4 (0.73) MRGPRX4KMOAKR1C3TTRNPC1
SCHEMBL27373055 0.81 MRGPRX4 (0.55) MRGPRX4ALDH1A1TTR
SCHEMBL2857675 0.80 AKR1C3 (0.73) MRGPRX4KMOAKR1C3ALDH1A1NPC1

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
CN-117043154-A GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof 卡莫特医疗有限公司 2023-11-10 — — CN disclosed
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