SCHEMBL21334736

SCHEMBL21334736

C[C@H](CC1CCNCC1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 3/20 0.58
CPB2 Q96IY4 3/20 0.58
GABRA5 P31644 3/20 0.42
GABRB2 P47870 3/20 0.42
SLC6A1 P30531 2/20 0.42
SLC6A12 P48065 2/20 0.42
SLC6A11 P48066 2/20 0.42
SLC6A13 Q9NSD5 2/20 0.42
GABRA1 P14867 2/20 0.42
GABRA4 P48169 2/20 0.42
GABRR1 P24046 1/20 0.42
TSHR P16473 2/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRE P78334 1/20 0.40

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
SCHEMBL13406394 1.00 CPN1 (0.58) CPN1CPB2GABRA5GABRB2SLC6A1
SCHEMBL25661086 0.89 SLC6A1 (0.53) CPN1CPB2GABRA5GABRB2SLC6A1
Hydrochloric Acid SCHEMBL3511980 0.87 SLC6A1 (0.52) CPN1CPB2GABRA5GABRB2SLC6A1
SCHEMBL19814903 0.85
SCHEMBL10138822 0.85
SCHEMBL18082679 0.85
SCHEMBL4234207 0.82 CPN1 (0.47) CPN1CPB2GABRA5GABRB2SLC6A1
SCHEMBL17276053 0.81 LTA4H (0.44)
SCHEMBL13285738 0.81 LTA4H (0.44)
SCHEMBL19815021 0.81 LTA4H (0.41) GABRR1CYP1A2

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-10407424-B2 Naphthyridines as inhibitors of HPK1 GENENTECH, INC. (US) 2019-09-10 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-10407424-B2 Naphthyridines as inhibitors of HPK1 NEK1, NEK5, NEK11 CPN1 1350/4885CPB2 1638/4885GABRA5 4662/4885

“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.