SCHEMBL30917263

SCHEMBL30917263

O=C1Cc2cc(C(F)(F)F)ccc2N1c1cc(Cl)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.43
TMPRSS4 Q9NRS4 5/20 0.40
CHRNA7 P36544 1/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 2/20 0.39
ALOX12 P18054 1/20 0.39
P2RX1 P51575 4/20 0.39
P2RX4 Q99571 3/20 0.39
P2RX7 Q99572 3/20 0.39
AADAT Q8N5Z0 1/20 0.39
MAT2A P31153 1/20 0.39
CYP2C9 P11712 2/20 0.38
HSP90AA1 P07900 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
CYP2C19 P33261 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL15069913 1.00 CRHR1 (0.43) CRHR1TMPRSS4CHRNA7KMT2AMEN1
SCHEMBL8911620 0.75 CYP2C9 (0.41) TMPRSS4CHRNA7KMT2AMEN1MAPT
SCHEMBL9150322 0.72 CYP2C9 (0.39) TMPRSS4CHRNA7KMT2AMEN1MAPT
SCHEMBL30364439 0.71 HTT (0.43) TMPRSS4CHRNA7KMT2AMEN1MAPT
SCHEMBL8998844 0.69 LMNA (0.54) KMT2AMEN1AADATNOTUM
SCHEMBL248856 0.68 NOTUM (0.56) CRHR1MAPTAADATTSHRNOTUM
SCHEMBL7893735 0.68 AADAT (0.47) CRHR1KMT2AMEN1MAPTP2RX4
SCHEMBL5857447 0.68 OPRK1 (0.41) KMT2AMEN1MAPTALOX12HSP90AA1
SCHEMBL27699836 0.67 CHRNA7 (0.41) TMPRSS4CHRNA7KMT2AMEN1MAPT
SCHEMBL3102522 0.67 HSP90AA1 (0.83) TMPRSS4KMT2AMEN1MAPTCYP2C9

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
US-11988661-B2 Rapid quantitative test to diagnose polycystic kidney disease UMC UTRECHT HOLDING, B.V. (NL) 2024-05-21 US disclosed