SCHEMBL19877367

SCHEMBL19877367

COC(=O)c1ccc(CCc2c(F)cc(N)cc2F)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.51
▸ CYP4A11 Q02928 2/20 0.51
▸ CCR6 P51684 1/20 0.51
▸ HKDC1 Q2TB90 1/20 0.51
▸ TP53 P04637 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ CKS1B P61024 1/20 0.50
▸ SKP2 Q13309 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ CYP4F2 P78329 1/20 0.50
▸ DHODH Q02127 3/20 0.48
▸ MAPT P10636 3/20 0.45

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
SCHEMBL19886997 0.87 CYP4A11 (0.53) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL12176925 0.81 LOXL2 (0.65) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL70185 0.79 CYP4A11 (0.75) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL15437144 0.78 MEN1 (0.65) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL12294453 0.78 MEN1 (0.65) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL16420936 0.78 CCR6 (0.52) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL5733406 0.77 CYP4A11 (0.72) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL3566972 0.77 LOXL2 (0.58) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL230590 0.76 LOXL2 (0.72) LOXL2CYP4A11CCR6HKDC1TP53
SCHEMBL17429664 0.75 CYP4A11 (0.60) LOXL2CYP4A11CCR6HKDC1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10934280-B2 Condensed thiophene derivatives useful as NaPi-IIb inhibitors ELI LILLY AND COMPANY (US) 2021-03-02 — — US disclosed
US-10934280-B2 Condensed thiophene derivatives useful as NaPi-IIb inhibitors ELI LILLY AND COMPANY (US) 2021-03-02 — — US disclosed
CN-109563070-B Fused thiophene derivatives as NAPI-IIB inhibitors 伊莱利利公司 2021-02-26 — — CN disclosed
EP-3497091-B1 CONDENSED THIOPHENE DERIVATIVES USEFUL AS NAPI-IIB INHIBITORS LILLY CO ELI (US) 2020-10-07 — — EP disclosed
US-20200031813-A1 CONDENSED THIOPHENE DERIVATIVES USEFUL AS NAPI-IIB INHIBITORS ELI LILLY AND COMPANY 2020-01-30 — — US disclosed
US-20200031813-A1 CONDENSED THIOPHENE DERIVATIVES USEFUL AS NAPI-IIB INHIBITORS ELI LILLY AND COMPANY 2020-01-30 — — US disclosed
EP-3497091-A1 CONDENSED THIOPHENE DERIVATIVES USEFUL AS NAPI-IIB INHIBITORS Eli Lilly and Company (US) 2019-06-19 — — EP disclosed
CN-109563070-A Fused thiophene derivative as NAPI-IIB inhibitor 伊莱利利公司 2019-04-02 — — CN disclosed
WO-2018034883-A1 CONDENSED THIOPHENE DERIVATIVES USEFUL AS NAPI-IIB INHIBITORS ELI LILLY AND COMPANY (US) 2018-02-22 — — WO 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-10934280-B2 Condensed thiophene derivatives useful as NaPi-IIb inhibitors SLC34A2, ALPI, SLC34A1 LOXL2 2552/4885CYP4A11 846/4885CCR6 4293/4885
US-20200031813-A1 CONDENSED THIOPHENE DERIVATIVES USEFUL AS NAPI-IIB INHIBITORS SLC34A2, ALPI, SLC34A1 LOXL2 2552/4885CYP4A11 846/4885CCR6 4293/4885

“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.

Send feedback