SCHEMBL21050808

SCHEMBL21050808

Nc1nccn2c([C@H]3CCN(C(=O)OCc4ccccc4)C3)nc(Br)c12

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 13/20 0.49
TNK2 Q07912 5/20 0.48
JAK2 O60674 1/20 0.46
JAK1 P23458 1/20 0.46
CYP2C19 P33261 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL28724598 1.00 IGF1R (0.49) IGF1RTNK2JAK2JAK1CYP2C19
SCHEMBL15929297 0.96 IGF1R (0.51) IGF1RTNK2JAK2JAK1
SCHEMBL14630461 0.95 IGF1R (0.51) IGF1RTNK2CYP2C19SMN1; SMN2
SCHEMBL21050896 0.93 IGF1R (0.50) IGF1RTNK2
SCHEMBL30449939 0.91 IGF1R (0.49) IGF1RTNK2JAK2JAK1
SCHEMBL28722982 0.89 JAK2 (0.46) IGF1RJAK2JAK1CYP2C19SMN1; SMN2
SCHEMBL12442146 0.89 JAK2 (0.47) JAK2JAK1CYP2C19SMN1; SMN2
SCHEMBL26359424 0.89 IGF1R (0.49) IGF1RTNK2JAK2JAK1
SCHEMBL21056239 0.89 JAK2 (0.46) IGF1RJAK2JAK1CYP2C19SMN1; SMN2
SCHEMBL14630466 0.87 GRIN2B (0.49) IGF1RTNK2

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-20240109896-A1 FGFR KINASE INHIBITOR AND USE THEREOF YA THERAPEUTICS INC (CN) 2024-04-04 US disclosed
WO-2022166469-A1 FGFR KINASE INHIBITOR AND USE THEREOF 药雅科技(上海)有限公司 2022-08-11 WO disclosed
CN-109715626-B Heterocyclic compounds as FGFR inhibitors 广州诺诚健华医药科技有限公司 2022-04-26 CN disclosed
US-10752631-B2 Heterocyclic compounds as FGFR inhibitors GUANGZHOU INNOCARE PHARMA TECH CO., LTD. (CN) 2020-08-25 US disclosed
EP-3498706-A1 HETEROCYCLIC COMPOUND AS FGFR INHIBITOR Guangzhou InnoCare Pharma Tech Co., Ltd. (CN) 2019-06-19 EP disclosed
US-20190177333-A1 HETEROCYCLIC COMPOUNDS AS FGFR INHIBITOR GUANGZHOU INNOCARE PHARMA TECH CO., LTD. (CN) 2019-06-13 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-20240109896-A1 FGFR KINASE INHIBITOR AND USE THEREOF FGFR1, FGFR2, FGFR3 IGF1R 44/4885TNK2 337/4885JAK2 11/4885
US-20190177333-A1 HETEROCYCLIC COMPOUNDS AS FGFR INHIBITOR FGFR1, FGFR3, FGFR2 IGF1R 18/4885TNK2 808/4885JAK2 73/4885
US-10752631-B2 Heterocyclic compounds as FGFR inhibitors FGFR1, FGFR3, FGFR2 IGF1R 18/4885TNK2 756/4885JAK2 72/4885

“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.