SCHEMBL25001376

SCHEMBL25001376

COCCN1CCC2(CCN(C)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.38
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
DRD2 P14416 2/20 0.35
DRD3 P35462 2/20 0.35
CYP2D6 P10635 4/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 2/20 0.33
ALOX15 P16050 1/20 0.33
GBA1 P04062 1/20 0.33
HDAC2 Q92769 2/20 0.32
TSHR P16473 2/20 0.32
HSPA9 P38646 1/20 0.32
HDAC1 Q13547 1/20 0.32
KDM1A O60341 1/20 0.31
MMP1 P03956 2/20 0.31
MMP2 P08253 2/20 0.31
MMP13 P45452 2/20 0.31
MMP14 P50281 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL23589140 0.88 HDAC2 (0.40) HSD11B1KDM4EMAPTDRD2DRD3
SCHEMBL23588941 0.88 USP2 (0.40) HSD11B1KDM4EMAPTDRD2DRD3
SCHEMBL25907682 0.86 HSD11B1 (0.37) HSD11B1KDM4EMAPTDRD2DRD3
SCHEMBL23588704 0.82 HDAC2 (0.37) HSD11B1DRD2DRD3CYP2D6CYP1A2
SCHEMBL18327901 0.82 CYP2D6 (0.47) HSD11B1DRD2DRD3CYP2D6ALDH1A1
SCHEMBL24854090 0.81 CYP2D6 (0.36) HSD11B1KDM4EDRD2DRD3CYP2D6
SCHEMBL23588914 0.80 HDAC2 (0.37) HSD11B1KDM4EMAPTDRD2DRD3
SCHEMBL23589026 0.80 USP2 (0.37) HSD11B1KDM4EMAPTALDH1A1GBA1
SCHEMBL84800 0.80 HSD11B1 (0.43) HSD11B1KDM4EMAPTDRD3ALDH1A1
SCHEMBL24378839 0.79 HSD11B1 (0.42) HSD11B1KDM4EDRD2DRD3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-07-13 US disclosed
US-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-07-13 US disclosed
WO-2023093728-A1 BRM SELECTIVE DEGRADATION AGENT COMPOUND AND USE THEREOF 江苏先声药业有限公司 2023-06-01 WO disclosed
EP-4129996-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR QILU PHARMACEUTICAL CO., LTD. (CN) 2023-02-08 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-20230219986-A1 NOVEL AMINOPYRIMIDINE EGFR INHIBITOR EGFR, ERBB2, ERBB4 HSD11B1 4623/4885KDM4E 1344/4885MAPT 1787/4885

“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.