SCHEMBL25544144

SCHEMBL25544144

COc1cccc(-c2cccn2C2(C(=O)C(C)C)CCCC2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA1 P02708 1/20 0.38
CHRNG P07510 1/20 0.38
CHRNB1 P11230 1/20 0.38
CHRNB2 P17787 1/20 0.38
SLC6A2 P23975 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA4 P43681 1/20 0.38
SLC6A3 Q01959 1/20 0.38
CHRND Q07001 1/20 0.38
JAK2 O60674 1/20 0.38
SLC16A3 O15427 4/20 0.38
SLC16A1 P53985 4/20 0.38
MCTS1 Q9ULC4 1/20 0.38
HTR1A P08908 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 0.37
HTR6 P50406 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37

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
SCHEMBL21747402 0.89 RECQL (0.38) JAK2SLC16A3SLC16A1MCTS1HTR1A
SCHEMBL21765700 0.88 JAK2 (0.38) JAK2HTR1ADRD2HTR2AHTR7
SCHEMBL21747276 0.87 ALDH1A1 (0.42) JAK2SLC16A3SLC16A1MCTS1HTR1A
SCHEMBL25543982 0.87 P2RX3 (0.37) SLC6A3SMN1; SMN2MAPTNPC1ALDH1A1
SCHEMBL25543943 0.83 EGLN1 (0.40) SLC6A2SLC6A3SMN1; SMN2MAPTALDH1A1
SCHEMBL25544014 0.82 EGLN1 (0.39) SLC6A2SLC6A3SMN1; SMN2MAPTPOLB
SCHEMBL25543987 0.78 EGLN1 (0.36) SLC6A3SMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL25544030 0.78 EGLN1 (0.38) MAPTALDH1A1HPGDNPSR1
SCHEMBL25543949 0.77 EGLN1 (0.35) SMN1; SMN2POLBALDH1A1TSHR
SCHEMBL25543967 0.77 KDM4E (0.36) SLC6A3SLC16A3SLC16A1MCTS1ALDH1A1

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-20230257379-A1 INDOLIZINE DERIVATIVES AND THEIR APPLICATION IN MEDICINE KIND PHARMACEUTICAL (CN) 2023-08-17 US disclosed
US-20230242527-A1 INDOLIZINE DERIVATIVES AND THEIR APPLICATION IN MEDICINE KIND PHARMACEUTICAL (CN) 2023-08-03 US disclosed
US-11655249-B2 Indolizine derivatives and their application in medicine KIND PHARMACEUTICAL (CN) 2023-05-23 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 (3 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-20230257379-A1 INDOLIZINE DERIVATIVES AND THEIR APPLICATION IN MEDICINE INMT, IDO1, IDO2 CHRNA1 1561/4885CHRNG 3305/4885CHRNB1 1652/4885
US-20230242527-A1 INDOLIZINE DERIVATIVES AND THEIR APPLICATION IN MEDICINE INMT, IDO1, IDO2 CHRNA1 1561/4885CHRNG 3305/4885CHRNB1 1652/4885
US-11655249-B2 Indolizine derivatives and their application in medicine INMT, IDO1, IDO2 CHRNA1 1561/4885CHRNG 3305/4885CHRNB1 1652/4885

“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.