SCHEMBL25554197

SCHEMBL25554197

CCCCCCCCNCCNC(C)CO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TSHR P16473 1/20 0.50
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
S1PR2 O95136 5/20 0.43
S1PR4 O95977 5/20 0.43
S1PR1 P21453 5/20 0.43
S1PR3 Q99500 5/20 0.43
S1PR5 Q9H228 1/20 0.43
ANPEP P15144 1/20 0.39
ERAP2 Q6P179 1/20 0.39
KDM4E B2RXH2 1/20 0.38
EPHX1 P07099 6/20 0.38
ADH1B P00325 2/20 0.38
ADH1C P00326 2/20 0.38
ADH1A P07327 2/20 0.38
ADH4 P08319 2/20 0.38
ADH7 P40394 2/20 0.38
LMNA P02545 1/20 0.38
CA1 P00915 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
SCHEMBL9745341 0.88 CNR1 (0.51) ALDH1A1TSHRCNR1CNR2KDM4E
SCHEMBL11683157 0.88 CNR1 (0.51) ALDH1A1TSHRCNR1CNR2KDM4E
SCHEMBL9745331 0.88 CNR1 (0.51) ALDH1A1TSHRCNR1CNR2KDM4E
SCHEMBL11599964 0.88 CNR1 (0.51) ALDH1A1TSHRCNR1CNR2KDM4E
SCHEMBL11599714 0.88 CNR1 (0.51) ALDH1A1TSHRCNR1CNR2KDM4E
Hydrochloric Acid SCHEMBL28158327 0.86 CNR1 (0.50) ALDH1A1TSHRCNR1CNR2KDM4E
Hydrochloric Acid SCHEMBL29058210 0.86 CNR1 (0.50) ALDH1A1TSHRCNR1CNR2KDM4E
SCHEMBL299216 0.86 CNR2 (0.49) ALDH1A1TSHRCNR1CNR2KDM4E
SCHEMBL26364841 0.83 LMNA (0.40) TSHRCNR1KDM4ELMNA
SCHEMBL24725721 0.79 TSHR (0.59) ALDH1A1TSHRS1PR2S1PR4S1PR1

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 ALDH1A1 4312/4885TSHR 13/4885CNR1 788/4885

“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.