SCHEMBL23055189

SCHEMBL23055189

CC(Cl)c1ccc(CN)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.46
LOXL2 Q9Y4K0 4/20 0.44
ABAT P80404 1/20 0.42
CSNK2A1 P68400 2/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
MAOB P27338 3/20 0.39
TAAR1 Q96RJ0 1/20 0.39
PSIP1 O75475 1/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
IDO1 P14902 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
SCHEMBL84104 0.80 IDO1 (0.58) HRH3LOXL2ABATCSNK2A1SLC6A2
SCHEMBL2865480 0.79 ADRB2 (0.41) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL4574471 0.78 TSHR (0.41) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL8750481 0.78 TSHR (0.64) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL13189390 0.78 ADRB2 (0.52) HRH3LOXL2ABATSLC6A2SLC6A3
SCHEMBL7677443 0.76 ABAT (0.48) HRH3LOXL2ABATSLC6A2TAAR1
SCHEMBL2406237 0.76 PTGS1 (0.53) TSHR
SCHEMBL2778066 0.76 ABAT (0.48) HRH3LOXL2ABATSLC6A2TAAR1
SCHEMBL23040222 0.76 TSHR (0.40) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL7372727 0.76 ABAT (0.48) HRH3LOXL2ABATSLC6A2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11584747-B2 Substituted pyridopyrimidinonyl compounds useful as T cell activators SYNGENE INTERNATIONAL LIMITED (IN) 2023-02-21 US disclosed
WO-2021041588-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-04 WO disclosed
US-20210061802-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS SYNGENE INTERNATIONAL LIMITED (IN) 2021-03-04 US disclosed
CN-109809962-A A kind of new synthetic method of 2- (4- bromomethyl) phenylpropionic acid 盘锦格林凯默科技有限公司 2019-05-28 CN disclosed
CN-101412670-B Method for synthesizing loxoprofen sodium ZHEJIANG APELOA PHARMACEUTICAL SCIENCE & TECHNOLOGY CO LTD 2011-11-09 CN disclosed
CN-101412670-A Method for synthesizing loxoprofen sodium ZHEJIANG PULUO PHARMACEUTICAL (CN) 2009-04-22 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 (2 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-11584747-B2 Substituted pyridopyrimidinonyl compounds useful as T cell activators DGKZ, DGKA, DGKG HRH3 1038/4885LOXL2 3987/4885ABAT 4180/4885
US-20210061802-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG HRH3 1038/4885LOXL2 3987/4885ABAT 4180/4885

“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.