SCHEMBL2022650

SCHEMBL2022650

Cc1cc(NC(=O)c2ccc(CCl)cc2)c(C)cc1NC(=O)c1ccc(CCl)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.59
KMT2A Q03164 1/20 0.59
NR1H4 Q96RI1 1/20 0.51
LMNA P02545 3/20 0.49
MAPT P10636 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
TAS1R2 Q8TE23 1/20 0.47
ALDH1A1 P00352 1/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
EGFR P00533 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL12514756 0.95 KMT2A (0.55) POLBKMT2ANR1H4LMNAMAPT
SCHEMBL2022473 0.93 KMT2A (0.56) POLBKMT2ANR1H4LMNAMAPT
SCHEMBL2024401 0.88 NR1H4 (0.53) POLBKMT2ANR1H4LMNAMAPT
SCHEMBL2024320 0.86 POLB (0.59) POLBKMT2ANR1H4MAPTSMN1; SMN2
SCHEMBL6486638 0.82 NPC1 (0.60) POLBKMT2AMAPTHDAC1HDAC8
SCHEMBL2025734 0.81 NPC1 (0.52) KMT2ALMNAMAPTSMN1; SMN2HDAC1
SCHEMBL6476512 0.81 HTT (0.74) KMT2ALMNAMAPTSMN1; SMN2RAB9A
SCHEMBL2024323 0.81 SMN1; SMN2 (0.47) POLBKMT2ANR1H4LMNASMN1; SMN2
SCHEMBL15437080 0.80 KCNMA1 (0.68) KMT2AMAPTSMN1; SMN2HDAC1NPC1
SCHEMBL13137727 0.80 GAA (0.58) KMT2AMAPTSMN1; SMN2HDAC1NPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8519040-B2 Ionic organic compound, production method thereof, hydrogelling agent composed of the ionic organic compound, hydrogel containing same, methanol gelling agent, methanol gel containing same, and carbon nanotube dispersant NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2013-08-27 US disclosed
US-20110178218-A1 IONIC ORGANIC COMPOUND, PRODUCTION METHOD THEREOF, HYDROGELLING AGENT COMPOSED OF THE IONIC ORGANIC COMPOUND, HYDROGEL CONTAINING SAME, METHANOL GELLING AGENT, METHANOL GEL CONTAINING SAME, AND CARBON NANOTUBE DISPERSANT National Institute of Avanced Industrial Science and Technology (JP) 2011-07-21 US disclosed
EP-2330143-A1 IONIC ORGANIC COMPOUND, PRODUCTION METHOD THEREOF, HYDROGELLING AGENT COMPOSED OF THE IONIC ORGANIC COMPOUND, HYDROGEL CONTAINING SAME, METHANOL GELLING AGENT, METHANOL GEL CONTAINING SAME, AND CARBON NANOTUBE DISPERSANT National Institute of Advanced Industrial Science And Technology (JP) 2011-06-08 EP disclosed