SCHEMBL21541739

SCHEMBL21541739

CN(C)CCCOc1ccc(-c2ccc3ncc4nnc(-n5ccnc5)n4c3c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 5/20 0.53
▸ CYP2D6 P10635 5/20 0.53
▸ CYP2C19 P33261 5/20 0.53
▸ CYP2C9 P11712 4/20 0.53
▸ CYP3A4 P08684 4/20 0.53
▸ ATM Q13315 7/20 0.47
▸ PRKDC P78527 1/20 0.47
▸ LSS P48449 1/20 0.39
▸ ATR Q13535 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ CCNT1 O60563 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ CDK9 P50750 1/20 0.39
▸ HSF1 Q00613 1/20 0.39
▸ DRD2 P14416 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ TLR7 Q9NYK1 2/20 0.36
▸ FGFR1 P11362 1/20 0.36
▸ SRC P12931 1/20 0.36

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
SCHEMBL21541825 0.81 ATM (0.51) ATMPRKDCLSSATRDRD2
SCHEMBL21541774 0.81 ATM (0.50) ATMPRKDCLSSATRDRD2
SCHEMBL21541735 0.80 ATM (0.58) CYP3A4ATMPRKDCLSSATR
SCHEMBL20374560 0.79 ATM (0.50) ATMPRKDCLSSATRDRD2
SCHEMBL21541736 0.79 ATM (0.50) ATMPRKDCLSSATRDRD2
SCHEMBL21541810 0.74 ATM (0.47) ATMPRKDCLSSATRDRD2
SCHEMBL21541879 0.74 PRKDC (0.81) ATMPRKDCATR
SCHEMBL30359521 0.74 PRKDC (0.81) ATMPRKDCATR
SCHEMBL21541748 0.73 ATM (0.56) ATMPRKDCLSSATR
SCHEMBL21541914 0.72 ATM (0.45) ATMPRKDCLSSATRDRD2

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
EP-3567041-A9 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2022-04-20 — — EP claimed
US-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2020-12-29 — — US claimed
EP-3567041-A1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics, Inc (CN) 2019-11-13 — — EP claimed
EP-3567041-A9 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2022-04-20 — — EP disclosed
US-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2020-12-29 — — US disclosed
EP-3567041-A1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics, Inc (CN) 2019-11-13 — — EP 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-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof CHEK1, CHEK2, CDK1 CYP1A2 2661/4885CYP2D6 931/4885CYP2C19 1452/4885

“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.

Send feedback