SCHEMBL25554252

SCHEMBL25554252

CC(C)NCCNCC(O)CO

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
KDM4E B2RXH2 2/20 0.33
CNR1 P21554 1/20 0.33
ADRA1A P35348 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ABCC3 O15438 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TYMP P19971 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
CYP2D6 P10635 1/20 0.30
ADRB3 P13945 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
SCHEMBL25554707 1.00 LMNA (0.33) LMNATDP1KDM4ECNR1ADRA1A
SCHEMBL25554534 1.00 LMNA (0.33) LMNATDP1KDM4ECNR1ADRA1A
SCHEMBL21691058 0.82 ALDH1A1 (0.36) LMNATDP1KDM4EALDH1A1TYMP
SCHEMBL14663224 0.81 LMNA (0.44) LMNAKDM4EALDH1A1SMN1; SMN2TYMP
SCHEMBL25554597 0.81
SCHEMBL24525596 0.80 TDP1 (0.39) LMNATDP1KDM4EALDH1A1SMN1; SMN2
SCHEMBL25554261 0.80 LMNA (0.34) LMNATDP1KDM4ECNR1ADRA1A
SCHEMBL25554569 0.79 KMT2A (0.41) KDM4EADRA1AALDH1A1SMN1; SMN2ADRB2
SCHEMBL25554489 0.79 KMT2A (0.41) KDM4EADRA1AALDH1A1SMN1; SMN2ADRB2
SCHEMBL4373913 0.79

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 LMNA 1955/4885TDP1 4180/4885KDM4E 4704/4885

“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.