SCHEMBL24920240

SCHEMBL24920240

CCCC(C)[C@H](C)c1ccncc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 3/20 0.44
▸ MAPT P10636 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ GAA P10253 2/20 0.36
▸ SLC6A4 P31645 2/20 0.35
▸ SLC6A3 Q01959 2/20 0.35
▸ CYP17A1 P05093 3/20 0.35
▸ CYP19A1 P11511 1/20 0.33
▸ CYP2D6 P10635 1/20 0.32

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
SCHEMBL23689570 0.78 SLC6A2 (0.42) SLC6A2MAPTLMNAMAPK1CYP3A4
SCHEMBL3424021 0.78 SLC6A2 (0.42) SLC6A2MAPTLMNAMAPK1CYP3A4
SCHEMBL24919761 0.77 MAPT (0.41) SLC6A2MAPTLMNACYP3A4CYP2C19
Hydrochloric Acid SCHEMBL16774806 0.77 SLC6A2 (0.41) SLC6A2MAPTLMNAMAPK1CYP3A4
SCHEMBL16919627 0.76 SLC6A2 (0.44) SLC6A2MAPTLMNAMAPK1CYP3A4
SCHEMBL23095174 0.75 ADRB2 (0.45) SLC6A2LMNAMAPK1SLC6A4SLC6A3
SCHEMBL9283159 0.75 ALDH1A1 (0.42) SLC6A2MAPTLMNAALDH1A1SLC6A3
SCHEMBL9229402 0.75 ALDH1A1 (0.42) SLC6A2MAPTLMNAALDH1A1SLC6A3
SCHEMBL10808259 0.72 SLC6A2 (0.41) SLC6A2MAPTLMNAMAPK1CYP3A4
SCHEMBL3741345 0.72 DPP4 (0.44) SLC6A2MAPTLMNAMAPK1CYP3A4

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-20230024302-A1 2,3,5-TRISUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS ARCUS BIOSCIENCES, INC. 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-20230024302-A1 2,3,5-TRISUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS PIK3CA, PIK3CG, PIK3CD SLC6A2 4879/4885MAPT 3674/4885LMNA 4493/4885

“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.

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