SCHEMBL24915960

SCHEMBL24915960

CCc1cc(N2CCN(C)CC2)c2nccc(C(C)C)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.41
DRD2 P14416 2/20 0.41
DRD4 P21917 2/20 0.41
HTR2A P28223 2/20 0.41
HTR2C P28335 2/20 0.41
DRD3 P35462 2/20 0.41
HRH4 Q9H3N8 7/20 0.38
KCNH2 Q12809 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
METAP1 P53582 1/20 0.34
TLR9 Q9NR96 2/20 0.34
TLR8 Q9NR97 2/20 0.34

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
SCHEMBL24915952 0.87 PIK3CA (0.37) MEN1LMNATP53KMT2ASMN1; SMN2
SCHEMBL24916004 0.86 LRRK2 (0.39) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL24915994 0.83 TLR9 (0.35) HTR1ATLR9TLR8TLR7ALK
SCHEMBL24915958 0.81 ELANE (0.43) HTR1ADRD2DRD3HRH4LRRK2
SCHEMBL24916055 0.81 DRD2 (0.41) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL24915990 0.80 PIK3CA (0.33)
SCHEMBL24916005 0.79 TLR9 (0.37) HTR1ADRD2HTR2AHTR2CTLR9
SCHEMBL24915986 0.77 SOS1 (0.38)
SCHEMBL22607274 0.74 HTR1A (0.47) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL22253420 0.73 NPC1 (0.36) HTR1AHTR2AHTR2CMEN1LMNA

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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 HTR1A 4192/4885DRD2 4534/4885DRD4 4435/4885

“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.