SCHEMBL26501697

SCHEMBL26501697

Cc1ccc(CC(=O)Nc2ccc(C(C)C(F)(F)F)cc2)nn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.41
ALDH1A1 P00352 2/20 0.38
DEGS1 O15121 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
HPGD P15428 1/20 0.37
CYP2D6 P10635 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
RAB9A P51151 2/20 0.37
GAA P10253 3/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TSHR P16473 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL26501545 0.86 SMN1; SMN2 (0.51) ALDH1A1SMN1; SMN2HPGDRAB9AMEN1
SCHEMBL26501695 0.85 SMN1; SMN2 (0.40) RORCALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL26501699 0.82 TSHR (0.44) ALDH1A1SMN1; SMN2HPGDRAB9AGAA
SCHEMBL26501696 0.82 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2HPGDCYP2D6RAB9A
SCHEMBL26501698 0.81 TSHR (0.43) ALDH1A1SMN1; SMN2HPGDRAB9AGAA
SCHEMBL26501672 0.80 PANK3 (0.43) RORCALDH1A1DEGS1HTTKDM4E
SCHEMBL26501693 0.78 MAPT (0.44) ALDH1A1SMN1; SMN2RAB9AHTTMEN1
SCHEMBL26501542 0.75 ALDH1A1 (0.43) RORCALDH1A1SMN1; SMN2HPGDRAB9A
SCHEMBL26501700 0.74 PTPN1 (0.40) ALDH1A1SMN1; SMN2PSEN1PSEN2APH1B
SCHEMBL2688260 0.74 DEGS1 (0.46) ALDH1A1DEGS1SMN1; SMN2HPGDRAB9A

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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2023-10-12 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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR HMGCR, GCDH, CYP11A1 RORC 2178/4885ALDH1A1 715/4885DEGS1 2553/4885

“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.