SCHEMBL20868007

SCHEMBL20868007

Nc1ccc2c(c1)OC[C@H]1COCCN21

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 17/20 0.51
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KRAS P01116 1/20 0.39
SOS1 Q07889 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL17076642 1.00 AAK1 (0.51) AAK1GAAMAPTSMN1; SMN2KRAS
SCHEMBL21455348 1.00 AAK1 (0.51) AAK1GAAMAPTSMN1; SMN2KRAS
SCHEMBL24629450 0.90 GAA (0.42) AAK1GAAMAPTSMN1; SMN2KDM4E
SCHEMBL29769194 0.90 GAA (0.42) AAK1GAAMAPTSMN1; SMN2KDM4E
SCHEMBL21455142 0.90 AAK1 (0.45) AAK1GAAMAPTSMN1; SMN2KRAS
SCHEMBL16440168 0.82 AAK1 (0.43) AAK1KRASSOS1
SCHEMBL13681594 0.81 CHRNB4 (0.46) AAK1GAAMAPTSMN1; SMN2KDM4E
SCHEMBL2789738 0.81 CHRNB4 (0.46) AAK1GAAMAPTSMN1; SMN2KDM4E
SCHEMBL5122248 0.81 CHRNB4 (0.46) AAK1GAAMAPTSMN1; SMN2KDM4E
SCHEMBL31392972 0.80 MAPT (0.41) AAK1GAAMAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3553064-B1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP HANGZHOU INNOGATE PHARMA CO LTD (CN) 2023-06-07 EP disclosed
US-20220153766-A1 CONDENSED TRICYCLIC COMPOUND USED AS KINASE INHIBITOR HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2022-05-19 US disclosed
US-10968234-B2 Compound containing tricyclic heteroaryl group HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2021-04-06 US disclosed
US-10934311-B2 Heterocyclic compound used as FGFR inhibitor HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2021-03-02 US disclosed
US-20200354376-A1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2020-11-12 US disclosed
WO-2020188467-A1 CONDENSED TRICYCLIC COMPOUND USED AS KINASE INHIBITOR 杭州英创医药科技有限公司 2020-09-24 WO disclosed
US-10730887-B2 Compound containing tricyclic heteroaryl group HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2020-08-04 US disclosed
EP-3553064-A1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP Hangzhou Innogate Pharma Co., Ltd. (CN) 2019-10-16 EP disclosed
US-20190308993-A1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2019-10-10 US disclosed
US-20190100531-A1 HETEROCYCLIC COMPOUND USED AS FGFR INHIBITOR HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2019-04-04 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 (7 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-20220153766-A1 CONDENSED TRICYCLIC COMPOUND USED AS KINASE INHIBITOR HCK, SBK1, ALK AAK1 72/4885GAA 3239/4885MAPT 2115/4885
US-20190308993-A1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP JAK3, ERBB3, CDK3 AAK1 732/4885GAA 3047/4885MAPT 2915/4885
US-20190100531-A1 HETEROCYCLIC COMPOUND USED AS FGFR INHIBITOR FGFR1, FGFR3, FGFR2 AAK1 1472/4885GAA 1045/4885MAPT 1756/4885
US-10934311-B2 Heterocyclic compound used as FGFR inhibitor FGFR1, FGFR3, FGFR2 AAK1 1472/4885GAA 1045/4885MAPT 1756/4885
US-10968234-B2 Compound containing tricyclic heteroaryl group JAK3, ERBB3, CDK3 AAK1 713/4885GAA 3217/4885MAPT 3013/4885
US-20200354376-A1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP JAK3, ERBB3, CDK3 AAK1 713/4885GAA 3217/4885MAPT 3013/4885
US-10730887-B2 Compound containing tricyclic heteroaryl group JAK3, ERBB3, CDK3 AAK1 732/4885GAA 3047/4885MAPT 2915/4885

“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.