SCHEMBL25680765

SCHEMBL25680765

Clc1nc(NCCN2CCOCC2)c2cnn(C3CCC(Cl)CC3)c2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
MAPK1 P28482 2/20 0.47
NR2F2 P24468 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CYP1A2 P05177 3/20 0.44
CYP3A4 P08684 3/20 0.44
CYP2D6 P10635 3/20 0.44
CYP2C19 P33261 3/20 0.44
HIF1A Q16665 2/20 0.44
ALOX15 P16050 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
NPC1 O15118 1/20 0.44
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42

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
SCHEMBL25680927 0.89 CYP3A4 (0.48) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL2189895 0.82 CYP1A2 (0.58) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL20102972 0.76 ALDH1A1 (0.74) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6823886 0.70 FLT3 (0.53)
SCHEMBL4088578 0.70 CYP1A2 (0.72) TSHRALDH1A1HSD17B10MAPK1CYP1A2
SCHEMBL24955563 0.69 PIK3CA (0.51) HRH3
SCHEMBL173599 0.69 PDE1C (0.50) PDE9A
SCHEMBL3915030 0.68 PIK3CA (0.52) HRH3
SCHEMBL31194614 0.68 PDE2A (0.56) KDM4ELMNAPDE9ATP53
SCHEMBL13312455 0.68 FLT3 (0.54) TSHRALDH1A1HSD17B10MAPK1CYP1A2

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-20230181589-A1 PRMT5 INHIBITORS FOR OCULAR THERAPY NATIONAL INSTITUTES OF HEALTH 2023-06-15 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-20230181589-A1 PRMT5 INHIBITORS FOR OCULAR THERAPY PRMT5, PRMT1, PRMT3 TSHR 2587/4885ALDH1A1 4366/4885KDM4E 66/4885

“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.