SCHEMBL18791377

SCHEMBL18791377

O=Nc1c(Cl)ccnc1Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 1/20 0.34
▸ LMNA P02545 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ AXL P30530 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ PMP22 Q01453 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ AURKA O14965 1/20 0.30
▸ AURKB Q96GD4 1/20 0.30
▸ MPI P34949 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL13827094 0.78 MAPT (0.35) DAOLMNAAXLPRKCIMAPT
SCHEMBL13911701 0.78 NR4A2 (0.36) LMNASMN1; SMN2MAPT
SCHEMBL12051931 0.78 RXFP1 (0.36) LMNASMN1; SMN2RXFP1MAPTKMT2A
SCHEMBL18811974 0.78 SMN1; SMN2 (0.35) LMNASMN1; SMN2MAPTKDM4EMEN1
SCHEMBL12503575 0.78 MGMT (0.35) DAOAXLPRKCIMAPTKDM4E
SCHEMBL1952444 0.77 GABRA1 (0.38) DAORXFP1CYP3A4MAPK1TDP1
SCHEMBL28861080 0.74 SMN1; SMN2 (0.52) LMNASMN1; SMN2CYP3A4MAPTKDM4E
SCHEMBL23323388 0.71 — —
SCHEMBL12636376 0.70 PDE4A (0.34) AXLHTT
SCHEMBL28676587 0.69 ATR (0.51) LMNASMN1; SMN2MAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210040115-A1 FUSED RING HETEROARYL COMPOUNDS AS RIPK1 INHIBITORS BISICHEM CO., LTD. (KR) 2021-02-11 — — US disclosed
US-10844056-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2020-11-24 — — US disclosed
US-20200062754-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2020-02-27 — — US disclosed
US-10428068-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2019-10-01 — — US disclosed
US-10233195-B2 Anti-fibrotic pyridinones INTERMUNE, INC. (US) 2019-03-19 — — US disclosed
US-20170121345-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 2017-05-04 — — US disclosed
US-9630965-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2017-04-25 — — 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 (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-10428068-B2 Fused amino pyridine as HSP90 inhibitors HSP90B1, HSP90AB1, HSP90AB2P DAO 1337/4885LMNA 4612/4885SMN1; SMN2 2620/4885
US-10233195-B2 Anti-fibrotic pyridinones MMP1, COL1A1, COL2A1 DAO 2381/4885LMNA 163/4885SMN1; SMN2 1395/4885
US-20200062754-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P DAO 1337/4885LMNA 4612/4885SMN1; SMN2 2620/4885
US-20170121345-A1 ANTI-FIBROTIC PYRIDINONES MMP1, COL1A1, COL2A1 DAO 2381/4885LMNA 163/4885SMN1; SMN2 1395/4885
US-10844056-B2 Fused amino pyridine as HSP90 inhibitors HSP90B1, HSP90AB1, HSP90AB2P DAO 1337/4885LMNA 4612/4885SMN1; SMN2 2620/4885
US-20210040115-A1 FUSED RING HETEROARYL COMPOUNDS AS RIPK1 INHIBITORS RIPK1, RIPK3, RIPK4 DAO 4568/4885LMNA 1639/4885SMN1; SMN2 3064/4885

“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.

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