SCHEMBL23909125

SCHEMBL23909125

O=c1[nH]nc(CBr)c2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.68
AR P10275 11/20 0.64
PARP1 P09874 1/20 0.64
LMNA P02545 2/20 0.62
POLB P06746 1/20 0.62
TSHR P16473 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.55
ALDH1A1 P00352 1/20 0.53

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
SCHEMBL29404780 1.00 PRMT5 (0.68) PRMT5ARPARP1LMNAPOLB
SCHEMBL6366635 0.81 PRMT5 (0.58) PRMT5ARPARP1LMNAPOLB
SCHEMBL30231202 0.81 PRMT5 (0.68) PRMT5ARPARP1LMNAPOLB
SCHEMBL21575704 0.81 PRMT5 (0.68) PRMT5ARPARP1LMNAPOLB
SCHEMBL7462930 0.81 PRMT5 (0.68) PRMT5ARPARP1LMNAPOLB
SCHEMBL6328127 0.81 PRMT5 (0.68) PRMT5ARPARP1LMNAPOLB
SCHEMBL4713938 0.81 PRMT5 (1.00) PRMT5ARPARP1LMNAPOLB
SCHEMBL31057993 0.81 PRMT5 (1.00) PRMT5ARPARP1LMNAPOLB
SCHEMBL4817305 0.81 PRMT5 (0.68) PRMT5ARPARP1LMNAPOLB
SCHEMBL6374999 0.80 PARP1 (0.59) PRMT5ARPARP1LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022036940-A1 PREPARATION METHOD FOR FLUZOPARIB 苏州富士莱医药股份有限公司 2022-02-24 WO claimed
CN-113234024-A Novel preparation method of olapari 北京迈索化学技术有限公司 2021-08-10 CN claimed
CN-111732594-B Preparation method of fluxaparide 苏州富士莱医药股份有限公司 2022-03-04 CN disclosed
CN-111732594-B Preparation method of fluxaparide 苏州富士莱医药股份有限公司 2022-03-04 CN disclosed
WO-2022036940-A1 PREPARATION METHOD FOR FLUZOPARIB 苏州富士莱医药股份有限公司 2022-02-24 WO disclosed
EP-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed
EP-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed
US-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GILEAD SCIENCES, INC. 2021-10-14 US disclosed
CN-113234024-A Novel preparation method of olapari 北京迈索化学技术有限公司 2021-08-10 CN disclosed
CN-113234024-A Novel preparation method of olapari 北京迈索化学技术有限公司 2021-08-10 CN disclosed
CN-111732594-A Preparation method of fluxaparide 苏州富士莱医药股份有限公司 2020-10-02 CN disclosed
CN-111732594-A Preparation method of fluxaparide 苏州富士莱医药股份有限公司 2020-10-02 CN disclosed
CN-110869359-A Novel compounds and pharmaceutical compositions thereof for the treatment of fibrosis 加拉帕戈斯股份有限公司 2020-03-06 CN 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-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS S1PR1, S1PR3, S1PR2 PRMT5 3849/4885AR 890/4885PARP1 633/4885

“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.