SCHEMBL25587352

SCHEMBL25587352

COC1CCCC1CNC(=O)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.38
FAP Q12884 1/20 0.38
EPHX2 P34913 1/20 0.34
PTGES O14684 1/20 0.32
OPRK1 P41145 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 2/20 0.30
MAPT P10636 1/20 0.30
HTR6 P50406 1/20 0.30
CKS1B P61024 1/20 0.30
SKP1 P63208 1/20 0.30
SKP2 Q13309 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
SCHEMBL24015554 0.81 MTNR1A (0.35) PREPFAPEPHX2ALDH1A1KDM4E
SCHEMBL18624725 0.75 EPHX1 (0.48) PREPFAPOPRK1SMN1; SMN2HSD17B10
SCHEMBL22107850 0.72 PREP (0.38) PREPFAPPTGESOPRK1SMN1; SMN2
SCHEMBL18624748 0.71 EPHX1 (0.53) PREPFAPEPHX2OPRK1SMN1; SMN2
SCHEMBL9795241 0.71 IDO1 (0.33) EPHX2SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL18535549 0.70
SCHEMBL12057456 0.70 TDP1 (0.54) PREPFAPOPRK1ALDH1A1CKS1B
SCHEMBL24234512 0.70
SCHEMBL8970106 0.70
SCHEMBL19652077 0.70 EPHX1 (0.57) PREPFAPEPHX2OPRK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230278958-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-09-07 US disclosed
US-20230278958-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-09-07 US disclosed
US-20230174538-A1 Tricyclic heterocycles MERCK PATENT GMBH (DE) 2023-06-08 US disclosed
US-20230174538-A1 Tricyclic heterocycles MERCK PATENT GMBH (DE) 2023-06-08 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 (2 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-20230278958-A1 TRICYCLIC HETEROCYCLES YAP1, TERF2IP, TEAD1 PREP 3851/4885FAP 2260/4885EPHX2 4109/4885
US-20230174538-A1 Tricyclic heterocycles YAP1, TEAD1, TERF2IP PREP 3626/4885FAP 2191/4885EPHX2 3994/4885

“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.