SCHEMBL31311072

SCHEMBL31311072

N#Cc1ccc(NC(=O)c2ccc(C(=O)O)cc2Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 1/20 0.58
GPR27 Q9NS67 1/20 0.58
TMPRSS4 Q9NRS4 1/20 0.56
TAS1R3 Q7RTX0 1/20 0.55
TAS1R1 Q7RTX1 1/20 0.55
TAS1R2 Q8TE23 1/20 0.55
PYGL P06737 3/20 0.52
KMT2A Q03164 5/20 0.49
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
UBE2N P61088 1/20 0.49
MLYCD O95822 1/20 0.49
MAPT P10636 2/20 0.49
HTT P42858 2/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
NLRP3 Q96P20 1/20 0.49
MEN1 O00255 4/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL12700436 0.86 HTT (0.53) AVPR2GPR27TMPRSS4TAS1R3TAS1R1
SCHEMBL12700431 0.86 HTT (0.53) AVPR2GPR27TMPRSS4TAS1R3TAS1R1
SCHEMBL31311058 0.86 TMPRSS4 (0.53) AVPR2GPR27TMPRSS4TAS1R3TAS1R1
SCHEMBL12700435 0.80 TMPRSS4 (0.73) AVPR2GPR27TMPRSS4TAS1R3TAS1R1
SCHEMBL18132546 0.80 TMPRSS4 (0.73) AVPR2GPR27TMPRSS4TAS1R3TAS1R1
SCHEMBL31311100 0.79 MLYCD (0.68) TAS1R3TAS1R1TAS1R2KMT2APOLB
SCHEMBL20764458 0.79 MLYCD (0.68) TAS1R3TAS1R1TAS1R2KMT2APOLB
SCHEMBL12700233 0.79 HTT (0.61) AVPR2GPR27TMPRSS4TAS1R3TAS1R1
SCHEMBL18132541 0.79 HTT (0.61) AVPR2GPR27TMPRSS4TAS1R3TAS1R1
SCHEMBL2500622 0.78 NPC1 (0.58) TMPRSS4TAS1R3TAS1R1TAS1R2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4731306-A1 CYSTOBACTAMID DERIVATIVES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2026-04-29 EP disclosed
WO-2025003147-A1 CYSTOBACTAMID DERIVATIVES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2025-01-02 WO disclosed