SCHEMBL18425047

SCHEMBL18425047

Cc1c(-c2ccc3nc(Cl)ccc3c2)ccnc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 2/20 0.40
▸ HPGD P15428 1/20 0.38
▸ DHODH Q02127 6/20 0.36
▸ BACE1 P56817 3/20 0.36
▸ CTSD P07339 1/20 0.36
▸ FFAR4 Q5NUL3 1/20 0.35
▸ MCL1 Q07820 1/20 0.34
▸ ABL1 P00519 2/20 0.34
▸ PIK3C3 Q8NEB9 1/20 0.34
▸ PIK3CD O00329 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ HCK P08631 1/20 0.34
▸ SRC P12931 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ PIK3CB P42338 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ PIK3CG P48736 1/20 0.34
▸ EPHB4 P54760 1/20 0.34
▸ PRKDC P78527 1/20 0.34

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
SCHEMBL18425042 0.82 KMO (0.39) KMOHPGDBACE1CTSDMCL1
SCHEMBL27237667 0.77 KMO (0.46) KMOHPGDDHODH
SCHEMBL21292981 0.77 BACE1 (0.39) HPGDBACE1CTSDABL1PIK3CD
SCHEMBL27689480 0.72 KDM4E (0.49) DHODH
SCHEMBL21292970 0.72 HPGD (0.39) HPGDBACE1CTSDABL1PIK3CD
SCHEMBL17909879 0.72 SRC (0.40) KMOHPGDBACE1ABL1PIK3CD
SCHEMBL30546878 0.72 AKR1C3 (0.41) KMODHODHABL1PIK3C3AKR1C3
SCHEMBL27927711 0.70 RORB (0.40) HPGDBACE1KDR
SCHEMBL17909883 0.70 SYK (0.38) HPGDBACE1ABL1PIK3CDEGFR
SCHEMBL21292979 0.69 SRC (0.40) HPGDBACE1CTSDABL1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10308637-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2019-06-04 — — US disclosed
US-20190002437-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2019-01-03 — — US disclosed
US-10023557-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2018-07-17 — — US disclosed
US-20170029406-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2017-02-02 — — 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 (4 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-10308637-B2 Therapeutic inhibitory compounds KLKB1, SERPINB1, SERPINE1 KMO 318/4885HPGD 140/4885DHODH 2024/4885
US-20170029406-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 KMO 318/4885HPGD 140/4885DHODH 2024/4885
US-10023557-B2 Therapeutic inhibitory compounds KLKB1, SERPINB1, SERPINE1 KMO 318/4885HPGD 140/4885DHODH 2024/4885
US-20190002437-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 KMO 318/4885HPGD 140/4885DHODH 2024/4885

“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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