SCHEMBL22924879

SCHEMBL22924879

CC(C)(C)CC(=O)Nc1ccc(-c2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.76
HPGD P15428 3/20 0.76
GAA P10253 1/20 0.76
MAPT P10636 1/20 0.76
NPC1 O15118 3/20 0.62
HTT P42858 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
MITF O75030 1/20 0.62
ALDH1A1 P00352 1/20 0.62
HDAC1 Q13547 4/20 0.58
HDAC2 Q92769 4/20 0.58
HDAC3 O15379 3/20 0.58
HDAC4 P56524 3/20 0.58
HDAC7 Q8WUI4 3/20 0.58
HDAC10 Q969S8 3/20 0.58
HDAC11 Q96DB2 3/20 0.58
HDAC8 Q9BY41 3/20 0.58
HDAC6 Q9UBN7 3/20 0.58
HDAC9 Q9UKV0 3/20 0.58
HDAC5 Q9UQL6 3/20 0.58

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
SCHEMBL4110940 0.89 MAPT (0.86) RAB9AHPGDGAAMAPTNPC1
SCHEMBL23518443 0.87 RAB9A (0.76) RAB9AHPGDGAAMAPTNPC1
SCHEMBL24473990 0.85 RAB9A (0.73) RAB9AHPGDGAAMAPTNPC1
SCHEMBL4299260 0.81 RAB9A (0.68) RAB9AHPGDGAAMAPTNPC1
SCHEMBL16201474 0.80 KMT2A (0.77) RAB9AHPGDGAAMAPTNPC1
SCHEMBL5649258 0.80 RAB9A (0.67) RAB9AHPGDGAAMAPTNPC1
SCHEMBL5328815 0.79 HPGD (0.65) RAB9AHPGDGAAMAPTNPC1
SCHEMBL23518442 0.79 RAB9A (0.65) RAB9AHPGDGAAMAPTNPC1
SCHEMBL10891853 0.79 CA1 (0.66) RAB9AHPGDGAAMAPTNPC1
SCHEMBL13167576 0.79 RAB9A (0.65) RAB9AHPGDGAAMAPTNPC1

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-20230020663-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2023-01-19 US disclosed
US-20230002352-A1 SULFONAMIDE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2023-01-05 US disclosed
US-20210024507-A1 Compounds STEP PHARMA S A S (FR) 2021-01-28 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 (3 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-20230020663-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS CTPS1, CTPS2, TYMS RAB9A 3047/4885HPGD 1669/4885GAA 974/4885
US-20230002352-A1 SULFONAMIDE DERIVATIVES AS CTPS1 INHIBITORS CTPS1, CTPS2, TYMS RAB9A 2956/4885HPGD 1666/4885GAA 1223/4885
US-20210024507-A1 Compounds CYP1A1, UGT1A1, CYP1A2 RAB9A 2248/4885HPGD 713/4885GAA 595/4885

“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.