SCHEMBL10163467

SCHEMBL10163467

Cc1cc(-c2c(Cl)cccc2Cl)no1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.49
NPC1 O15118 5/20 0.49
MAPT P10636 5/20 0.46
GAA P10253 2/20 0.45
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
LMNA P02545 2/20 0.42
TSHR P16473 1/20 0.41
P2RX7 Q99572 1/20 0.40
HTT P42858 1/20 0.39

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
SCHEMBL11671866 0.92 RAB9A (0.52) RAB9ANPC1MAPTGAAKDM4E
SCHEMBL6086455 0.88 L3MBTL1 (0.50) RAB9ANPC1GAAALDH1A1SMN1; SMN2
SCHEMBL6834291 0.82 L3MBTL1 (0.54) RAB9ANPC1MAPTGAAKDM4E
SCHEMBL16482131 0.80 IDO1 (0.49) RAB9ANPC1MAPTGAAKDM4E
SCHEMBL30338333 0.79 CYP1A2 (0.50) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL28281773 0.79 RAB9A (0.38) RAB9ANPC1KDM4EALDH1A1POLB
SCHEMBL995408 0.79 CYP1A2 (0.50) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL23302623 0.78 SMN1; SMN2 (0.47) RAB9ANPC1MAPTGAAKDM4E
SCHEMBL27788974 0.78 MAPT (0.48) RAB9AMAPTGAAKDM4EALDH1A1
SCHEMBL27534068 0.77 CHRNB2 (0.43) RAB9ANPC1MAPTALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339870-A1 CINNAMIC AMIDE DERIVATIVE HAVING FXR ACTIVATING EFFECT, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT, AND METHOD FOR PREPARING THE SAME KYUNGSUNG UNIVERSITY INDUSTRY COOPERATION FOUNDATION (KR) 2023-10-26 US claimed
WO-2021085991-A1 CINNAMIC AMIDE DERIVATIVE HAVING FXR ACTIVATING EFFECT, PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT, AND PREPARATION METHOD THEREFOR 경성대학교 산학협력단 2021-05-06 WO disclosed
CN-108659007-A A kind of preparation method of dicloxacillin sodium pillar-shaped crystal 华北制药集团先泰药业有限公司 2018-10-16 CN disclosed
EP-2409985-A2 Inhibitors de serine proteases, especially of the NS3 protease of the hepatitis C virus VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-01-25 EP disclosed
EP-2314598-A1 Inhibitors of Hepatitis C virus NS3 serine protease VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-04-27 EP disclosed
EP-0229369-A2 Cephalosporins, process for their preparation and pharmaceutical compositions containing them Takeda Chemical Industries, Ltd. (JP) 1987-07-22 EP disclosed
US-3971776-A MICROBIOCIDE E. R. SQUIBB & SONS, INC. (US) 1976-07-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230339870-A1 CINNAMIC AMIDE DERIVATIVE HAVING FXR ACTIVATING EFFECT, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT, AND METHOD FOR PREPARING THE SAME CEL, NR1H4, FXR1 RAB9A 1432/4885NPC1 24/4885MAPT 2640/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.