SCHEMBL25839263

SCHEMBL25839263

CCCC(C)Cc1ccc2c(c1)CNC2

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
HTR6 P50406 2/20 0.39
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
MPO P05164 1/20 0.31
TLR7 Q9NYK1 2/20 0.30

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
SCHEMBL17229355 0.81 GABRA1 (0.43) DRD2DRD3HTR6HTR2AHTR2C
SCHEMBL27641244 0.78 PNMT (0.49) HTR2AHTR2C
SCHEMBL21335649 0.75 DRD2 (0.47) DRD2DRD3HTR6HTR2AHTR2C
SCHEMBL8179926 0.75 DRD2 (0.42) DRD2DRD3HTR6HTR2AHTR2C
SCHEMBL19891712 0.71 CHRM2 (0.45)
SCHEMBL7770508 0.70 ESR1 (0.41) DRD2DRD3HTR6
SCHEMBL23095177 0.69 ALDH1A1 (0.36) DRD2DRD3HTR2A
SCHEMBL6569194 0.69 ALOX15 (0.63) DRD2DRD3HTR2A
SCHEMBL18583848 0.69 PNMT (0.50) DRD2DRD3
SCHEMBL19281909 0.69 ASIC3 (0.50) DRD2DRD3HTR2C

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-20230227484-A1 PYRIMIDINE COMPOUND AS AXL INHIBITOR NANJING CHIA TAI TIANQING PHARMACEUTICAL CO., LTD. (CN) 2023-07-20 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-20230227484-A1 PYRIMIDINE COMPOUND AS AXL INHIBITOR AXL, FLT3, TYMP DRD2 3514/4885DRD3 4175/4885HTR6 2666/4885

“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.