SCHEMBL22462375

SCHEMBL22462375

CC(C)CC1CCCC(NC(=O)CC(C(N)=O)C(CC(N)=O)C(N)=O)C1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.35
RAB9A P51151 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
EPHX1 P07099 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
CPB2 Q96IY4 1/20 0.31
ECE1 P42892 1/20 0.31
GAA P10253 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL22462379 0.88 HPGD (0.35) HPGDRAB9ACYP3A4CYP2C19EPHX1
SCHEMBL22462399 0.84 KMT2A (0.36) HPGDRAB9ACYP3A4CYP2C19KMT2A
SCHEMBL2452123 0.84 HPGD (0.41) HPGDRAB9ACYP3A4CYP2C19EPHX1
SCHEMBL22462376 0.83 HPGD (0.37) HPGDRAB9ACYP3A4CYP2C19EPHX1
SCHEMBL2454558 0.79 HPGD (0.38) HPGDRAB9ACYP3A4CYP2C19EPHX1
SCHEMBL24448966 0.78 HPGD (0.41) HPGDRAB9ACYP3A4CYP2C19EPHX1
SCHEMBL16138558 0.75 ALDH1A1 (0.45) HPGDRAB9AEPHX1KMT2ASMN1; SMN2
SCHEMBL22462423 0.73 CYP3A4 (0.37) HPGDRAB9ACYP3A4CYP2C19KMT2A
SCHEMBL24449510 0.73 EPHX1 (0.44) RAB9ACYP3A4EPHX1SMN1; SMN2GAA
SCHEMBL22462431 0.71 SMYD3 (0.36) HPGDRAB9ACYP3A4CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200384678-A1 DECORATIVE FILM AND METHOD FOR MANUFACTURING DECORATIVE MOLDED ARTICLE USING SAME JAPAN POLYPROPYLENE CORPORATION (JP) 2020-12-10 US disclosed
EP-3715092-A1 DECORATIVE FILM AND METHOD FOR MANUFACTURING DECORATIVE MOLDED ARTICLE USING SAME Japan Polypropylene Corporation (JP) 2020-09-30 EP disclosed
US-20160289262-A1 BILE ACID DERIVATIVES AS FXR/TGR5 AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2016-10-06 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-20160289262-A1 BILE ACID DERIVATIVES AS FXR/TGR5 AGONISTS AND METHODS OF USE THEREOF GPBAR1, NR1H4, SLC10A1 HPGD 1549/4885RAB9A 1942/4885CYP3A4 478/4885

“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.