SCHEMBL23349366

SCHEMBL23349366

CC(CCCN)C1CCCCC2CCCCCC2CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.36
TP53 P04637 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CPB2 Q96IY4 2/20 0.33
SHBG P04278 1/20 0.32
MEN1 O00255 1/20 0.31
MITF O75030 1/20 0.31
KMT2A Q03164 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
SCHEMBL6014461 0.91 EPHX1 (0.43) EPHX1TP53SIGMAR1KDM4EGMNN
SCHEMBL12322284 0.89 EPHX1 (0.39) EPHX1TP53SIGMAR1KDM4EGMNN
SCHEMBL22839344 0.89 EPHX1 (0.39) EPHX1TP53SIGMAR1KDM4EGMNN
SCHEMBL9376499 0.85 SIGMAR1 (0.42) EPHX1TP53SIGMAR1KDM4EGMNN
SCHEMBL20042193 0.83 SIGMAR1 (0.45) EPHX1TP53SIGMAR1KDM4EGMNN
SCHEMBL26460968 0.78 EPHX1 (0.46) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL22921029 0.78 EPHX1 (0.46) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL6062805 0.78 EPHX1 (0.46) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL20145288 0.77 SIGMAR1 (0.38) EPHX1SIGMAR1LMNABLMCPB2
SCHEMBL10729418 0.76 EPHX1 (0.42) EPHX1TP53KDM4EGMNNLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210139482-A1 SUBSTITUTED 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDIN-3-ONES RECURIUM IP HOLDINGS, LLC 2021-05-13 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 (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-20210139482-A1 SUBSTITUTED 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDIN-3-ONES MKI67, BRCA1, CCNI EPHX1 2660/4885TP53 23/4885SIGMAR1 3178/4885

“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.