SCHEMBL25854283

SCHEMBL25854283

Cc1cc2ccccc2nc1Nc1ccc(OC(F)(F)P)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.45
SMN1; SMN2 Q16637 5/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 4/20 0.40
KDM4E B2RXH2 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
HTT P42858 2/20 0.39
EPHX2 P34913 1/20 0.38
ALDH1A1 P00352 2/20 0.38
CTSC P53634 1/20 0.38
NPY5R Q15761 1/20 0.36
ABL1 P00519 1/20 0.36
BCR P11274 1/20 0.36
DHODH Q02127 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL1706301 0.90 SMN1; SMN2 (0.51) MAPTSMN1; SMN2MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL13517466 0.89 SMN1; SMN2 (0.50) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL1706249 0.81 MAPT (0.67) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL1702525 0.78 IGF1R (0.53) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL1702147 0.78 MAPT (0.46) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL22134947 0.77 KDM1A (0.49) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL1702502 0.76 KDM4E (0.54) MAPTSMN1; SMN2KMT2ARAB9ANPC1
SCHEMBL22116277 0.74 CTSC (0.59) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL29569079 0.74 MAPT (0.57) MAPTMEN1KMT2ANPC1GAA
SCHEMBL12993921 0.74 MAPT (0.57) MAPTMEN1KMT2ANPC1GAA

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-4215196-A1 COMBINATION OF 8-CHLORO-N-(4-(TRIFLUOROMETHOXY)PHENYL)QUINOLIN-2-AMINE AND ITS DERIVATIVES WITH A JAK INHIBITOR ABIVAX (FR) 2023-07-26 EP disclosed