SCHEMBL473490

SCHEMBL473490

Clc1nccc(-n2nnc3ccccc32)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.59
MAPK8 P45983 8/20 0.54
MAPK9 P45984 8/20 0.54
CCNE1 P24864 7/20 0.54
CDK2 P24941 7/20 0.54
MAPK10 P53779 7/20 0.52
CYP2C9 P11712 3/20 0.52
RPS6KA5 O75582 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 1/20 0.48
CDK1 P06493 1/20 0.47
CDK4 P11802 1/20 0.47
CCNB1 P14635 1/20 0.47
CCND1 P24385 1/20 0.47
KCNMA1 Q12791 1/20 0.44
MKNK2 Q9HBH9 1/20 0.40
SLC9A1 P19634 2/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL10103846 0.81 RAB9A (0.59) RAB9AMAPK8MAPK9CCNE1CDK2
SCHEMBL473446 0.78 RAB9A (0.55) RAB9AMAPK8MAPK9CCNE1CDK2
SCHEMBL10104143 0.76 RAB9A (0.52) RAB9AMAPK8MAPK9CCNE1CDK2
SCHEMBL473574 0.76 MAPK8 (0.56) RAB9AMAPK8MAPK9CCNE1CDK2
SCHEMBL678640 0.75 RAB9A (1.00) RAB9AMAPK8MAPK9CCNE1CDK2
SCHEMBL30355239 0.75 RAB9A (1.00) RAB9AMAPK8MAPK9CCNE1CDK2
SCHEMBL473534 0.74 MKNK2 (0.56) RAB9ACYP2C9RPS6KA5SMN1; SMN2TSHR
SCHEMBL19100862 0.74 RPS6KA5 (0.58) RAB9AMAPK8MAPK9CDK2MAPK10
SCHEMBL30459875 0.73 MKNK1 (0.51) MAPK8MAPK9MAPK10RPS6KA5CDK1
SCHEMBL17683140 0.73 MKNK1 (0.51) MAPK8MAPK9MAPK10RPS6KA5CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208967-A1 Pyrimidine or Pyridine Compounds, Preparation Method Therefor and Pharmaceutical Uses Thereof INVENTISBIO CO LTD (CN) 2024-06-27 US disclosed
US-11203589-B2 Pyrimidine or pyridine compounds, preparation method therefor and pharmaceutical uses thereof InventisBio Co., Ltd. (CN) 2021-12-21 US disclosed
EP-3885344-A2 PYRIMIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF InventisBio Co., Ltd. (CN) 2021-09-29 EP disclosed
US-20190152969-A1 PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF INVENTISBIO SHANGHAI LTD. (CN) 2019-05-23 US disclosed
US-10179784-B2 Pyrimidine or pyridine compounds, preparation method therefor and pharmaceutical uses thereof INVENTISBIO SHANGHAI LTD. (CN) 2019-01-15 US disclosed
US-20170355696-A1 PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF InventisBio Co., Ltd. (CN) 2017-12-14 US disclosed
US-20170355696-A1 PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF InventisBio Co., Ltd. (CN) 2017-12-14 US disclosed
EP-3216786-A1 PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF Shanghai Shaletech Technology Co., Ltd. (CN) 2017-09-13 EP disclosed
US-8962622-B2 Benzotriazole kinase modulators ROCHE PALO ALTO LLC (US) 2015-02-24 US disclosed
EP-2066319-B1 BENZOTRIAZOLE KINASE MODULATORS HOFFMANN LA ROCHE (CH) 2012-02-01 EP disclosed
CN-101511359-A Benzotriazole kinase modulators HOFFMANN LA ROCHE (CH) 2009-08-19 CN disclosed
EP-2066319-A1 BENZOTRIAZOLE KINASE MODULATORS F. Hoffmann-Roche AG (CH) 2009-06-10 EP disclosed
US-20080103142-A1 Benzotriazole kinase modulators ROCHE PALO ALTO LLC 2008-05-01 US disclosed
WO-2008028860-A1 BENZOTRIAZOLE KINASE MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2008-03-13 WO 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 (6 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-20190152969-A1 PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF EGFR, WEE1, DPYD RAB9A 1035/4885MAPK8 119/4885MAPK9 225/4885
US-20240208967-A1 Pyrimidine or Pyridine Compounds, Preparation Method Therefor and Pharmaceutical Uses Thereof EGFR, WEE1, DPYD RAB9A 1035/4885MAPK8 119/4885MAPK9 225/4885
US-11203589-B2 Pyrimidine or pyridine compounds, preparation method therefor and pharmaceutical uses thereof EGFR, WEE1, TP53 RAB9A 954/4885MAPK8 167/4885MAPK9 215/4885
US-20170355696-A1 PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF EGFR, WEE1, DPYD RAB9A 935/4885MAPK8 158/4885MAPK9 218/4885
US-10179784-B2 Pyrimidine or pyridine compounds, preparation method therefor and pharmaceutical uses thereof EGFR, WEE1, DPYD RAB9A 1035/4885MAPK8 119/4885MAPK9 225/4885
US-20080103142-A1 Benzotriazole kinase modulators CDK1, CDK3, MAPK1 RAB9A 3749/4885MAPK8 61/4885MAPK9 65/4885

“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.