SCHEMBL17439199

SCHEMBL17439199

Cc1nc2ccc(Br)cc2n1C1CCN(C(=O)O)C1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
DYRK1A Q13627 1/20 0.45
FPR2 P25090 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
MAPK1 P28482 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
PKM P14618 3/20 0.41
USP2 O75604 1/20 0.41
KDR P35968 1/20 0.41
UBE2N P61088 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD11B1 P28845 2/20 0.40
HRH3 Q9Y5N1 1/20 0.39
CCR5 P51681 4/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL15526387 0.90 L3MBTL1 (0.43) LMNADYRK1AFPR2SMN1; SMN2MAPK1
SCHEMBL15332887 0.85 USP30 (0.51) LMNADYRK1AFPR2PKMUSP2
SCHEMBL15333767 0.85 USP30 (0.51) LMNADYRK1AFPR2PKMUSP2
SCHEMBL15333523 0.85 USP30 (0.51) LMNADYRK1AFPR2PKMUSP2
SCHEMBL19689424 0.80 USP30 (0.48) LMNAFPR2SMN1; SMN2MAPK1L3MBTL1
SCHEMBL17678202 0.79 CDK9 (0.51) DYRK1AL3MBTL1KDM4EALDH1A1CCR5
SCHEMBL30847394 0.79 CDK9 (0.51) DYRK1AL3MBTL1KDM4EALDH1A1CCR5
SCHEMBL15333264 0.77 USP30 (0.45) FPR2CCR5
SCHEMBL2493364 0.77 CDK9 (0.60) LMNADYRK1AL3MBTL1KDM4EALDH1A1
SCHEMBL17586642 0.77 CDK9 (0.56) LMNADYRK1AMAPK1L3MBTL1KDM4E

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-20160015690-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-01-21 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-20160015690-A1 THERAPEUTIC COMPOUNDS NQO1, HAVCR2, CCR5 LMNA 3781/4885DYRK1A 4870/4885FPR2 1471/4885

“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.