SCHEMBL31428639

SCHEMBL31428639

Cc1cc(-c2ccccc2-c2ccccc2)c2cc(C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)ccc2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.47
GBA1 P04062 2/20 0.45
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC4 P56524 1/20 0.44
CKS1B P61024 1/20 0.44
SKP1 P63208 1/20 0.44
SKP2 Q13309 1/20 0.44
CRBN Q96SW2 1/20 0.44
AKT1 P31749 1/20 0.44
KIT P10721 1/20 0.42
ADAM17 P78536 4/20 0.42
SMARCA2 P51531 1/20 0.42
SMARCA4 P51532 1/20 0.42
PBRM1 Q86U86 1/20 0.42
BACE1 P56817 1/20 0.42
LMNA P02545 1/20 0.42
SMYD3 Q9H7B4 1/20 0.42

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
SCHEMBL24977037 1.00 CNR2 (0.47) CNR2GBA1ALDH1A1MAPTMEN1
SCHEMBL31428571 0.87 HPGD (0.45) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL31428616 0.86 MAPT (0.60) GBA1ALDH1A1MAPTMEN1KMT2A
SCHEMBL31428537 0.83 PDCD1 (0.52) ALDH1A1MAPTLMNA
SCHEMBL30163537 0.83 TLR9 (0.50) CNR2ALDH1A1MAPT
SCHEMBL31428875 0.82 ABCG2 (0.49) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL30163482 0.80 ALDH1A1 (0.44) ALDH1A1MAPTLMNA
SCHEMBL31429064 0.79 POLB (0.47) ALDH1A1MAPTMEN1KMT2ASMYD3
SCHEMBL20467457 0.79 ALDH1A1 (0.71) ALDH1A1MAPTMEN1KMT2AHDAC4
SCHEMBL31428793 0.79 KDM4E (0.46) ALDH1A1

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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS CNR2 3760/4885GBA1 3597/4885ALDH1A1 2352/4885

“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.