SCHEMBL30186608

SCHEMBL30186608

COc1c(F)ccc2ccn(C(=O)O)c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 3/20 0.35
PARP1 P09874 2/20 0.33
MEP1B Q16820 1/20 0.33
ACLY P53396 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
CHRNA7 P36544 1/20 0.32
HTR3A P46098 1/20 0.32
TFPI2 P48307 1/20 0.32
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 2/20 0.31
HSD17B10 Q99714 2/20 0.31
HPGD P15428 1/20 0.31
NOTUM Q6P988 1/20 0.31
TUBB4A P04350 2/20 0.31
TUBB P07437 2/20 0.31
TUBA3C P0DPH7 2/20 0.31
TUBA1B P68363 2/20 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
SCHEMBL26684156 0.81 TUBB1 (0.38) TUBB1PARP1LMNAHTTKDM4E
SCHEMBL30705789 0.80 MEP1B (0.32) TUBB1MEP1BACLYCHRNA7HTR3A
SCHEMBL30705808 0.80 MEP1B (0.32) TUBB1PARP1MEP1BACLYCHRNA7
SCHEMBL31358141 0.77 OXER1 (0.36) PARP1RAB9A
SCHEMBL8481891 0.74 ALDH1A1 (0.54) TUBB1LMNATFPI2KDM4EALDH1A1
SCHEMBL30705807 0.73 FABP4 (0.45) PARP1ACLYRAB9ANOTUM
SCHEMBL30405202 0.72 FABP4 (0.48) LMNARAB9AKDM4EALDH1A1HSD17B10
SCHEMBL26683977 0.70 PARP1 (0.31) PARP1RAB9A
SCHEMBL26683728 0.67 PARP1 (0.33) PARP1RAB9AKDM4EALDH1A1HSD17B10
SCHEMBL31549585 0.67 KDM4E (0.35) PARP1LMNARAB9ATFPI2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111954525-B Prodrugs of fused bicyclic C5aR antagonists 凯莫森特里克斯股份有限公司 2023-12-26 CN disclosed
US-11608336-B2 Prodrugs of fused-bicyclic C5aR antagonists CHEMOCENTRYX, INC. (US) 2023-03-21 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-11608336-B2 Prodrugs of fused-bicyclic C5aR antagonists C5AR2, C5AR1, C3AR1 TUBB1 4665/4885PARP1 2041/4885MEP1B 1367/4885

“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.