SCHEMBL19360593

SCHEMBL19360593

CCn1c(Cc2ccc(C(F)(F)F)cc2F)cc2cc(C(=O)OC)ccc21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
RORC P51449 6/20 0.43
ACSS2 Q9NR19 1/20 0.40
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
KIF11 P52732 2/20 0.37
IDH1 O75874 1/20 0.37
TLR2 O60603 1/20 0.37
TLR1 Q15399 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.36
NOTUM Q6P988 1/20 0.36
PTGER4 P35408 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 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
SCHEMBL19360594 0.89 RORC (0.42) KDM4ERORCACSS2KMT2APTGER4
SCHEMBL19360388 0.85 RORC (0.55) KDM4ERORCACSS2IDH1
SCHEMBL19360322 0.85 RORC (0.49) RORCKIF11IDH1TLR2TLR1
SCHEMBL19360539 0.83 RORC (0.46) KDM4ERORCIDH1TLR2TLR1
SCHEMBL19360520 0.82 KIF11 (0.51) KDM4ERORCACSS2KIF11NOTUM
SCHEMBL19360556 0.79 RORC (0.51) RORCPTGER4PPARG
SCHEMBL19360339 0.79 RORC (0.64) RORC
SCHEMBL18440914 0.78 RORC (0.52) KDM4ERORCRAB9AKMT2AIDH1
SCHEMBL19360616 0.77 KDM4E (0.48) KDM4ERORCACSS2RAB9AIDH1
SCHEMBL19360605 0.76 IDH1 (0.47) KDM4ERORCACSS2IDH1MRGPRX4

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
CN-107531679-B Aromatic amide derivative, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2021-07-02 CN disclosed
CN-107531679-A Aromatic amides analog derivative, its preparation method and its application in medicine 江苏恒瑞医药股份有限公司 2018-01-02 CN disclosed
WO-2017157332-A1 AROMATIC AMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL APPLICATIONS THEREOF 江苏恒瑞医药股份有限公司 2017-09-21 WO disclosed