SCHEMBL25484384

SCHEMBL25484384

O=C(c1ccccc1)N1CCC2(CC1)C[C@@H]1OC[C@@H](c3ccccc3)N1C2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 4/20 0.46
CRBN Q96SW2 2/20 0.42
KDM4E B2RXH2 2/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DDB1 Q16531 1/20 0.42
ACHE P22303 1/20 0.41
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
EPHX1 P07099 1/20 0.39
L3MBTL3 Q96JM7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL25483631 1.00 RIPK1 (0.46) RIPK1CRBNKDM4EKMT2ASMN1; SMN2
SCHEMBL25198986 0.90 HSD11B1 (0.34) RIPK1CRBNSMN1; SMN2DDB1ALDH1A1
SCHEMBL25484607 0.82 USP30 (0.44) KDM4ESMN1; SMN2TSHRHRH3
SCHEMBL25188450 0.79 OPRD1 (0.35) KMT2ATSHR
SCHEMBL25485348 0.78 CRBN (0.41) RIPK1CRBNDDB1ACHEALDH1A1
SCHEMBL25188224 0.74 L3MBTL3 (0.45) RIPK1CRBNKDM4EKMT2ASMN1; SMN2
SCHEMBL25482830 0.74 L3MBTL3 (0.45) RIPK1CRBNKDM4EKMT2ASMN1; SMN2
SCHEMBL25192684 0.73 RIPK1 (0.45) RIPK1CRBNKDM4EKMT2ADDB1
SCHEMBL25483663 0.72 OPRD1 (0.36) KMT2ASMN1; SMN2ALDH1A1TSHRHPGD
SCHEMBL25193108 0.72 OPRD1 (0.36) KMT2ASMN1; SMN2ALDH1A1TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12180226-B2 Spirotricycle RIPK1 inhibitors and methods of uses thereof MERCK SHARP & DOHME LLC (US) 2024-12-31 US disclosed
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-05-25 US disclosed
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-05-25 US disclosed
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-05-25 US disclosed
WO-2023076218-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-05-04 WO 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-12180226-B2 Spirotricycle RIPK1 inhibitors and methods of uses thereof RIPK1, RIPK3, RIPK4 RIPK1 1/4885CRBN 4505/4885KDM4E 3571/4885
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF RIPK1, RIPK3, RIPK4 RIPK1 1/4885CRBN 4505/4885KDM4E 3571/4885

“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.