SCHEMBL28495673

SCHEMBL28495673

NC(=O)N(C(=O)c1c(Cl)cccc1Cl)c1ccc(Br)c(Br)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.36
ALDH1A1 P00352 1/20 0.36
CXCR1 P25024 1/20 0.33
CXCR2 P25025 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
NPC1 O15118 2/20 0.33
KMT2A Q03164 2/20 0.33
ITGB2 P05107 1/20 0.33
ICAM1 P05362 1/20 0.33
ITGAL P20701 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
POLB P06746 1/20 0.32
FAAH O00519 1/20 0.32
F2R P25116 1/20 0.32

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
SCHEMBL28509729 0.91 RORC (0.36) RORCALDH1A1NPC1KMT2AMEN1
SCHEMBL7757536 0.88 RORC (0.41) RORCALDH1A1KMT2AITGB2ICAM1
SCHEMBL7759289 0.84 ALDH1A1 (0.39) RORCALDH1A1GPBAR1NPC1KMT2A
SCHEMBL28500688 0.84 RORC (0.39) RORCALDH1A1GPBAR1KMT2AMEN1
SCHEMBL29034050 0.81 ALDH1A1 (0.37) RORCALDH1A1NPC1KMT2AMEN1
SCHEMBL28500692 0.80 ALDH1A1 (0.41) RORCALDH1A1GPBAR1NPC1MAPT
SCHEMBL7760787 0.80 RORC (0.45) RORCALDH1A1KMT2AITGB2ICAM1
SCHEMBL7759298 0.80 RORC (0.34) RORCALDH1A1CXCR1CXCR2GPBAR1
SCHEMBL7753768 0.80 RORC (0.42) RORCALDH1A1GPBAR1ITGB2ICAM1
SCHEMBL28904678 0.79 POLB (0.44) ALDH1A1GPBAR1KMT2AMEN1MAPT

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
CN-111988996-A Increasing yield of nut bearing plants UPL有限责任公司 2020-11-24 CN claimed
CN-111988996-A Increasing yield of nut bearing plants UPL有限责任公司 2020-11-24 CN disclosed