SCHEMBL2581803

SCHEMBL2581803

Clc1cc2nc(Cl)ccc2cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
PIK3CD O00329 1/20 0.38
NPC1 O15118 2/20 0.34
KDM4E B2RXH2 2/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CDC7 O00311 1/20 0.33
CDK2 P24941 1/20 0.33
RAB9A P51151 1/20 0.33
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32

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
SCHEMBL24457825 0.85 BACE1 (0.47) PIK3CD
SCHEMBL11004060 0.82 PIK3CD (0.38) ALDH1A1PIK3CDNPC1KDM4ECRHBP
SCHEMBL23166179 0.81 ERN1 (0.32) ALDH1A1KDM4ENAPRTCYP3A4CYP2D6
SCHEMBL20967213 0.81 FGFR1 (0.49) PIK3CDCDK2EGFR
SCHEMBL31105852 0.81 CYP1A2 (0.45) ALDH1A1KDM4ECYP3A4SMN1; SMN2CYP2A6
SCHEMBL23167279 0.81 S1PR4 (0.33) ALDH1A1KDM4ECYP3A4CYP2D6SLC6A2
SCHEMBL23165847 0.81 PDGFRB (0.32) ALDH1A1PIK3CDKDM4ESMN1; SMN2CDC7
SCHEMBL23166915 0.81 CYP1A2 (0.50) KDM4EPOLB
SCHEMBL15507200 0.81 ALDH1A1 (0.34) ALDH1A1PIK3CDNPC1KDM4ECRHBP
SCHEMBL30381780 0.81 ALDH1A1 (0.34) ALDH1A1PIK3CDNPC1KDM4ECRHBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118515653-B EZH2 specific inhibitor and preparation method and application thereof 西湖制药(杭州)有限公司 2024-12-10 CN disclosed
CN-118515653-A EZH2 specific inhibitor and preparation method and application thereof 西湖制药(杭州)有限公司 2024-08-20 CN disclosed
US-20220389009-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GFB (ABC), LLC 2022-12-08 US disclosed
US-20220389009-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GFB (ABC), LLC 2022-12-08 US disclosed
EP-4037683-A1 SUBSTITUTED 1, 6-NAPHTHYRIDINE INHIBITORS OF CDK5 Goldfinch Bio, Inc. (US) 2022-08-10 EP disclosed
CN-114761000-A Substituted 1, 6-naphthyridine inhibitors of CDK5 金翅雀生物公司 2022-07-15 CN disclosed
WO-2022011274-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2022-01-13 WO disclosed
WO-2022011274-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2022-01-13 WO disclosed
WO-2021067569-A1 SUBSTITUTED 1, 6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2021-04-08 WO disclosed
WO-2021067569-A1 SUBSTITUTED 1, 6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2021-04-08 WO disclosed
EP-3630759-A1 ION CHANNEL INHIBITOR COMPOUNDS FOR CANCER TREATMENT Centre National De La Recherche Scientifique (FR) 2020-04-08 EP disclosed
WO-2018215557-A1 ION CHANNEL INHIBITOR COMPOUNDS FOR CANCER TREATMENT CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-11-29 WO disclosed
WO-2011135259-A1 PYRIDO[3,2-D]PYRIMIDINE DERIVATIVES, PROCESSES FOR PREPARING SAME AND THERAPEUTIC USES THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2011-11-03 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 (1 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-20220389009-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 CDK5, CDK5R1, PKD1 ALDH1A1 2375/4885PIK3CD 353/4885NPC1 2168/4885

“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.