SCHEMBL6094823

SCHEMBL6094823

CC(C)C(C(=O)Nc1ccc2[nH]c(-c3nccs3)nc2c1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
TSHR P16473 1/20 0.53
TTK P33981 1/20 0.45
FFAR2 O15552 3/20 0.44
HDAC1 Q13547 8/20 0.43
HDAC3 O15379 7/20 0.43
HDAC8 Q9BY41 6/20 0.43
HDAC4 P56524 5/20 0.43
HDAC6 Q9UBN7 5/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HDAC2 Q92769 4/20 0.42
HDAC7 Q8WUI4 3/20 0.42
HDAC10 Q969S8 3/20 0.42
HDAC11 Q96DB2 3/20 0.42
HDAC9 Q9UKV0 3/20 0.42
HDAC5 Q9UQL6 3/20 0.42
RAB9A P51151 3/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL6091959 1.00 LMNA (0.53) LMNATSHRTTKFFAR2HDAC1
SCHEMBL4363672 0.91 FFAR2 (0.55) LMNAFFAR2MEN1KMT2A
SCHEMBL20707804 0.86 ADORA2A (0.46) KMT2ARAB9AMAPTKDM4ENPC1
SCHEMBL6092098 0.86 HSD17B10 (0.46) TSHRRAB9AMAPTKDM4ENPC1
SCHEMBL4367695 0.81 METAP1 (0.48) LMNATSHRTTKFFAR2HDAC1
SCHEMBL4370870 0.81 METAP1 (0.48) LMNATSHRTTKFFAR2HDAC1
SCHEMBL4371134 0.81 METAP1 (0.48) LMNATSHRTTKFFAR2HDAC1
SCHEMBL4371236 0.81 ROCK2 (0.47) LMNARAB9AMAPTKDM4ENPC1
SCHEMBL6093781 0.81 MAPT (0.53) MEN1KMT2ARAB9AMAPTKDM4E
SCHEMBL4372123 0.79 ALDH1A1 (0.49) LMNAMEN1KMT2ARAB9AMAPT

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-20060036098-A1 Carbonylamino-benzimidazole derivatives as androgen receptor modulators MERCK SHARP & DOHME CORP. 2006-02-16 US claimed

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-20060036098-A1 Carbonylamino-benzimidazole derivatives as androgen receptor modulators AR, SHBG, BRCA1 LMNA 2221/4885TSHR 1721/4885TTK 4178/4885

“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.