SCHEMBL9739302

SCHEMBL9739302

Clc1nc2ccccc2n1Cl.c1ccc2c(c1)ccc1[nH]cnc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 2/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.38
ALDH1A1 P00352 4/20 0.37
MAPT P10636 3/20 0.37
HPGD P15428 3/20 0.37
PRNP P04156 2/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.32
PARP1 P09874 3/20 0.31
AURKA O14965 1/20 0.31
DAPK3 O43293 1/20 0.31
JAK2 O60674 1/20 0.31

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
SCHEMBL51008 0.79 LMNA (0.61) LMNAMEN1KMT2APOLBNPC1
SCHEMBL30330977 0.78 LMNA (0.59) LMNAMEN1KMT2APOLBNPC1
Bromide SCHEMBL27972711 0.78 LMNA (0.59) LMNAMEN1KMT2APOLBNPC1
Naphthalene SCHEMBL9683208 0.78 LMNA (0.59) LMNAMEN1KMT2APOLBNPC1
SCHEMBL9740193 0.78 ALDH1A1 (0.44) LMNAMEN1KMT2APOLBNPC1
Benzimidazole SCHEMBL8417549 0.77 LMNA (0.51) LMNAMEN1KMT2APOLBNPC1
Naphthalene SCHEMBL9739118 0.76 LMNA (0.50) LMNAMEN1KMT2APOLBNPC1
SCHEMBL66294 0.74 SMN1; SMN2 (0.63) LMNAMEN1KMT2ANPC1RAB9A
Carbazole SCHEMBL29134578 0.72 LMNA (0.53) LMNAMEN1KMT2APOLBNPC1
SCHEMBL10692862 0.72 LMNA (0.53) LMNAMEN1KMT2APOLBNPC1

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-5139909-A Unsymmetrical XEROX CORPORATION (US) 1992-08-18 US disclosed