SCHEMBL21055558

SCHEMBL21055558

Cc1ccc(S(=O)(=O)OC2CCC(Oc3ccccc3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
CYP1A2 P05177 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HRH1 P35367 1/20 0.42
MAPT P10636 2/20 0.42
FPR2 P25090 2/20 0.41
PROKR1 Q8TCW9 2/20 0.41
ALDH1A1 P00352 1/20 0.40
FFAR1 O14842 1/20 0.40
VDR P11473 1/20 0.40
HTR2C P28335 1/20 0.39
EPHX2 P34913 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL21055560 1.00 CYP2D6 (0.53) CYP2D6SMN1; SMN2HTTCYP3A4CYP2C19
SCHEMBL21055454 0.87 CYP2D6 (0.52) CYP2D6SMN1; SMN2CYP2C19CYP1A2MEN1
SCHEMBL21055453 0.87 CYP2D6 (0.52) CYP2D6SMN1; SMN2CYP2C19CYP1A2MEN1
SCHEMBL657896 0.86 CYP2D6 (0.67) CYP2D6SMN1; SMN2CYP3A4CYP2C19CYP1A2
SCHEMBL10376015 0.86 CYP2D6 (0.67) CYP2D6SMN1; SMN2CYP3A4CYP2C19CYP1A2
SCHEMBL1500377 0.82 CYP2D6 (0.53) CYP2D6SMN1; SMN2HTTCYP3A4CYP2C19
SCHEMBL8705318 0.82 CYP2D6 (0.53) CYP2D6SMN1; SMN2HTTCYP3A4CYP2C19
SCHEMBL21055393 0.81 CYP2D6 (0.49) CYP2D6CYP3A4CYP2C19CYP1A2MEN1
SCHEMBL21055396 0.81 CYP2D6 (0.49) CYP2D6CYP3A4CYP2C19CYP1A2MEN1
SCHEMBL718466 0.80 CYP2D6 (0.51) CYP2D6SMN1; SMN2HTTCYP3A4CYP2C19

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-11247990-B1 Bicyclic fused pyridine compounds as inhibitors of TAM kinases ARRAY BIOPHARMA INC (US) 2022-02-15 US disclosed
WO-2019113190-A1 BICYCLIC FUSED PYRIDINE COMPOUNDS AS INHIBITORS OF TAM KINASES ARRAY BIOPHARMA INC. (US) 2019-06-13 WO 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-11247990-B1 Bicyclic fused pyridine compounds as inhibitors of TAM kinases MAP3K1, MAP3K3, MAP3K2 CYP2D6 3215/4885SMN1; SMN2 3848/4885HTT 4589/4885

“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.