SCHEMBL20147259

SCHEMBL20147259

C[C@H]1CO[C@@H](CO)[C@@H]1OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.52
PDE4D Q08499 1/20 0.41
PDPK1 O15530 1/20 0.41
MTOR P42345 1/20 0.41
CYP2C19 P33261 2/20 0.40
TSHR P16473 1/20 0.40
TACR2 P21452 1/20 0.39
BCHE P06276 2/20 0.37
MAPT P10636 1/20 0.37
RECQL P46063 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ACHE P22303 1/20 0.36

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
SCHEMBL12162838 1.00 SLC6A2 (0.52) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL8714420 0.92 SLC6A2 (0.48) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL8714419 0.92 SLC6A2 (0.48) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL8718030 0.92 SLC6A2 (0.48) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL2692797 0.89 SLC6A2 (0.48) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL23225625 0.82 SLC6A2 (0.52) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL20107393 0.82 SLC6A2 (0.58) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL22710225 0.82 SLC6A2 (0.58) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL20193189 0.82 SLC6A2 (0.58) SLC6A2PDE4DPDPK1MTORCYP2C19
SCHEMBL24894599 0.82 SLC6A2 (0.58) SLC6A2PDE4DPDPK1MTORCYP2C19

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10010549-B2 Biheteroaryl compounds and uses thereof GENENTECH, INC. (US) 2018-07-03 US disclosed
US-20180133219-A1 BIHETEROARYL COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-05-17 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 (2 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-10010549-B2 Biheteroaryl compounds and uses thereof BCHE, SNCA, HAX1 SLC6A2 2666/4885PDE4D 2694/4885PDPK1 3710/4885
US-20180133219-A1 BIHETEROARYL COMPOUNDS AND USES THEREOF BCHE, SNCA, HAX1 SLC6A2 2666/4885PDE4D 2694/4885PDPK1 3710/4885

“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.