SCHEMBL23259359

SCHEMBL23259359

C/C=C/c1ccc(Cl)nn1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 1/20 0.59
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.35
▸ MAPT P10636 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ CYP1A2 P05177 1/20 0.31
▸ NOS2 P35228 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ LMNA P02545 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
SCHEMBL25403261 0.81 — —
SCHEMBL18246890 0.74 APLNR (1.00) APLNRKMT2AMEN1NOS2
SCHEMBL18246892 0.74 APLNR (1.00) APLNRKMT2AMEN1NOS2
SCHEMBL3510562 0.74 KMT2A (0.35) APLNRKMT2AMEN1ALDH1A1MAPT
SCHEMBL12678605 0.73 APLNR (0.59) APLNRKMT2AMEN1NOS2
SCHEMBL25023811 0.72 ALDH1A1 (0.35) APLNRKMT2AMEN1ALDH1A1MAPT
SCHEMBL1483826 0.71 — —
Hydrochloric Acid SCHEMBL28549560 0.71 ALDH1A1 (0.38) KMT2AMEN1ALDH1A1MAPTGAA
SCHEMBL3585742 0.71 — —
SCHEMBL13505667 0.71 KDM4E (0.46) KMT2AMEN1ALDH1A1MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11229636-B2 Substituted tetrahydroquinolinone compounds as ROR gamma modulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2022-01-25 — — US disclosed
US-20210113551-A9 SUBSTITUTED TETRAHYDROQUINOLINONE COMPOUNDS AS ROR GAMMA MODULATORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2021-04-22 — — 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 (2 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-11229636-B2 Substituted tetrahydroquinolinone compounds as ROR gamma modulators RORC, RORA, RORB APLNR 1766/4885KMT2A 2114/4885MEN1 4325/4885
US-20210113551-A9 SUBSTITUTED TETRAHYDROQUINOLINONE COMPOUNDS AS ROR GAMMA MODULATORS RORC, RORA, RORB APLNR 1766/4885KMT2A 2114/4885MEN1 4325/4885

“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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