SCHEMBL25555490

SCHEMBL25555490

CCc1ncc(C)cc1C(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.33
NOS2 P35228 2/20 0.33
CCR1 P32246 1/20 0.33
CCR5 P51681 1/20 0.33
CCR8 P51685 1/20 0.33
NOS1 P29475 1/20 0.33
BTK Q06187 1/20 0.33
GRM5 P41594 1/20 0.32
CXCR4 P61073 1/20 0.32
APLNR P35414 1/20 0.31
TRPA1 O75762 1/20 0.31
LMNA P02545 1/20 0.31
CHRM1 P11229 1/20 0.31
SLC6A2 P23975 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
PSMD14 O00487 1/20 0.31
COPS5 Q92905 1/20 0.31
CYP1A2 P05177 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL19301652 0.78 AGBL2 (0.39)
SCHEMBL19301653 0.76 P2RX3 (0.38) NOS3NOS2NOS1CYP1A2SMN1; SMN2
SCHEMBL16386821 0.74 SLC13A5 (0.40) NOS3NOS2CCR1CCR5CCR8
SCHEMBL873234 0.74 NOS3 (0.48) NOS3NOS2CCR1CCR5CCR8
SCHEMBL29384905 0.74 NOS3 (0.48) NOS3NOS2CCR1CCR5CCR8
SCHEMBL2738314 0.74 CCR1 (0.38) NOS3NOS2CCR1CCR5CCR8
SCHEMBL20321338 0.72 NOS3 (0.41) NOS3NOS2CCR1CCR5CCR8
SCHEMBL25816541 0.72 CCR1 (0.37) NOS3NOS2CCR1CCR5CCR8
SCHEMBL13438492 0.72 CCR1 (0.37) NOS3NOS2CCR1CCR5CCR8
SCHEMBL24139999 0.72 NOS3 (0.33) NOS3NOS2CCR1CCR5CCR8

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-20230159532-A1 PARATHYROID HORMONE (PTH) RECEPTOR ANTAGONISTS AND USES THEREOF Crinetics Pharmaceuticals, Inc. 2023-05-25 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-20230159532-A1 PARATHYROID HORMONE (PTH) RECEPTOR ANTAGONISTS AND USES THEREOF PTH1R, CALCR, VDR NOS3 4739/4885NOS2 4844/4885CCR1 3711/4885

“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.