SCHEMBL31464401

SCHEMBL31464401

CC1(O)CCN(C(=O)c2ccc(-c3ccc4nccc(Cl)c4c3)c(F)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FASN P49327 3/20 0.46
SMYD3 Q9H7B4 1/20 0.43
MAPKAPK2 P49137 1/20 0.42
MGLL Q99685 2/20 0.42
PKLR P30613 1/20 0.41
HTR1A P08908 6/20 0.41
SLC22A12 Q96S37 1/20 0.39
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
HPGD P15428 1/20 0.38
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
MTOR P42345 1/20 0.38

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
SCHEMBL31464356 0.89 HPGD (0.50) FASNSMYD3MAPKAPK2MGLLKCNH2
SCHEMBL31464497 0.88 HPGD (0.52) FASNSMYD3MAPKAPK2MGLLKCNH2
SCHEMBL31464602 0.86 PKM (0.48) SMYD3MGLLHPGD
SCHEMBL31464555 0.85 ALOX5AP (0.46) FASNSMYD3MAPKAPK2MGLL
SCHEMBL31464721 0.85 MAPKAPK2 (0.42) FASNSMYD3MAPKAPK2MGLLSLC22A12
SCHEMBL31464760 0.83 SMYD3 (0.49) SMYD3MAPKAPK2MGLL
SCHEMBL31464436 0.82 P2RX7 (0.45) FASNSMYD3MAPKAPK2MGLLKCNH2
SCHEMBL31464384 0.82 ENPP2 (0.40) FASNSMYD3MGLLSLC22A12
SCHEMBL31464514 0.82 MGLL (0.41) FASNSMYD3MAPKAPK2MGLLSLC22A12
SCHEMBL31464521 0.81 SMYD3 (0.52) FASNSMYD3MGLLKCNH2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025064853-A1 RIPK3 INHIBITORS AND METHODS OF USE Momentum Therapeutics, Inc. (US) 2025-03-27 WO disclosed
US-20250092031-A1 RIPK3 INHIBITORS AND METHODS OF USE INTEGRAL BIOSCIENCES PVT. LTD. (IN) 2025-03-20 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-20250092031-A1 RIPK3 INHIBITORS AND METHODS OF USE RIPK3, RIPK1, RIPK2 FASN 2688/4885SMYD3 1845/4885MAPKAPK2 169/4885

“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.