SCHEMBL21535103

SCHEMBL21535103

Fc1cc(Br)ccc1NCC(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
NPC1 O15118 5/20 0.41
ALDH1A1 P00352 5/20 0.41
RAB9A P51151 4/20 0.41
ALOX12 P18054 4/20 0.41
TP53 P04637 2/20 0.41
HPGD P15428 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
MAPT P10636 6/20 0.38
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GRK2 P25098 1/20 0.38
RECQL P46063 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 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
SCHEMBL422450 0.82 L3MBTL1 (0.44) LMNASMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL3413889 0.80 KDM1A (0.39) ALDH1A1POLB
SCHEMBL29473306 0.80 AAK1 (0.39) ALDH1A1HPGDL3MBTL1MAPTMEN1
SCHEMBL16110940 0.80 ALDH1A1 (0.41) LMNASMN1; SMN2ALDH1A1RAB9AL3MBTL1
SCHEMBL18827200 0.78 TRPM5 (0.50) LMNASMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL18235935 0.78 KDM4E (0.43) LMNAMAPTMEN1KMT2AGAA
SCHEMBL27169591 0.77 LMNA (0.39) LMNASMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL6931205 0.77 SMN1; SMN2 (0.48) LMNASMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL17678181 0.76 LMNA (0.39) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL20014808 0.76 LMNA (0.32) LMNA

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-3212642-B1 AMIDE SUBSTITUTED THIAZOLES AS MODULATORS OF RORGAMMAT JANSSEN PHARMACEUTICA NV (BE) 2019-10-30 EP disclosed