SCHEMBL24001033

SCHEMBL24001033

CCCN1C(=O)c2cc(C)ccc2Oc2cccnc21

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 4/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL20684994 0.84 BRD4 (0.38) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL20690375 0.78 CHRM2 (0.37) LMNAMEN1KMT2A
SCHEMBL21982244 0.76 BRD4 (0.44) MAPTLMNAMEN1KMT2AGAA
SCHEMBL20684997 0.74 RXFP1 (0.40) MAPTLMNASMN1; SMN2POLBMEN1
SCHEMBL9369457 0.68 CYP3A4 (0.47) MAPTLMNASMN1; SMN2POLBMEN1
SCHEMBL15046557 0.68 CHRM2 (0.60)
SCHEMBL12963725 0.68 ADRA2A (0.47) MEN1KMT2A
SCHEMBL8936588 0.68 MAPT (0.50) MAPTLMNASMN1; SMN2POLBMEN1
SCHEMBL9099840 0.68 MAPT (0.58) MAPTLMNASMN1; SMN2POLBMEN1
SCHEMBL23835579 0.67 CHRM2 (0.50) MAPTLMNASMN1; SMN2MEN1KMT2A

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-20210347742-A1 CFTR REGULATORS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-11-11 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-20210347742-A1 CFTR REGULATORS AND METHODS OF USE THEREOF CFTR, SLC26A4, CLCN2 MAPT 4825/4885LMNA 4267/4885SMN1; SMN2 4229/4885

“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.