SCHEMBL23612477

SCHEMBL23612477

Cc1ccc(C(N)c2ccc(C)o2)c(N)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.39
▸ HSD17B10 Q99714 1/20 0.37
▸ CA1 P00915 1/20 0.36
▸ MEN1 O00255 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ TRPA1 O75762 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ ADRA1A P35348 1/20 0.32

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
SCHEMBL20424499 0.84 TDP1 (0.34) TDP1TP53ALDH1A1MEN1MAPT
SCHEMBL23589330 0.81 HTR2B (0.33) TDP1ALDH1A1MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL20424530 0.80 HTR2B (0.35) TDP1ALDH1A1MEN1MAPTKMT2A
SCHEMBL20424779 0.79 ACHE (0.43) CYP3A4SMN1; SMN2ALDH1A1HSD17B10MEN1
SCHEMBL23589316 0.78 ADORA2A (0.35) TDP1SMN1; SMN2ALDH1A1MEN1MAPT
Hydrochloric Acid SCHEMBL20425142 0.78 ALOX5 (0.33) TDP1ALDH1A1MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL20425018 0.76 ADORA2A (0.35) SMN1; SMN2TRPA1LMNACHRM1SLC6A2
Hydrochloric Acid SCHEMBL20424616 0.76 ADORA2A (0.35) SMN1; SMN2TRPA1LMNACHRM1SLC6A2
SCHEMBL23589298 0.74 MAPT (0.35) TP53THRBALDH1A1MEN1MAPT
SCHEMBL17872095 0.73 MAPT (0.36) TDP1ALOX15TP53THRBALDH1A1

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-11052092-B2 N-{[2-(piperidin-1-yl)phenyl](phenyl)methyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)acetamide derivatives and related compounds as ROR-gamma modulators for treating autoimmune diseases GENFIT (FR) 2021-07-06 — — 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-11052092-B2 N-{[2-(piperidin-1-yl)phenyl](phenyl)methyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)acetamide derivatives and related compounds as ROR-gamma modulators for treating autoimmune diseases RORA, RORC, RORB TDP1 4432/4885ALOX15 2108/4885CYP3A4 876/4885

“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.

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