SCHEMBL20767162

SCHEMBL20767162

Cc1ncc(B(O)O)cc1C(=O)Nc1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CXCR1 P25024 11/20 0.48
CXCR2 P25025 11/20 0.48
IDO1 P14902 2/20 0.48
NR3C1 P04150 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 1/20 0.44

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
SCHEMBL20767328 0.87 RAB9A (0.53) NPC1ALDH1A1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21629972 0.82 IDO1 (0.48) RAB9ASMN1; SMN2CXCR1CXCR2IDO1
SCHEMBL20766944 0.82 HDAC1 (0.50)
SCHEMBL20767333 0.81 RAB9A (0.51) NPC1ALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL21630009 0.80 MEN1 (0.48) NPC1RAB9ASMN1; SMN2CXCR1CXCR2
SCHEMBL20881365 0.77 IDO1 (0.48) NPC1ALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL20766870 0.74 MAPK1 (0.54) ALDH1A1RAB9ACXCR1CXCR2LMNA
SCHEMBL30566676 0.74 MAPK1 (0.54) ALDH1A1RAB9ACXCR1CXCR2LMNA
SCHEMBL20766929 0.73 CXCR2 (0.52) NPC1ALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL14942693 0.72 AHR (0.56) NPC1ALDH1A1GAARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112384283-B Therapeutic heterocyclic compounds 吉利德科学公司 2023-08-15 CN disclosed
US-11229638-B2 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. (US) 2022-01-25 US disclosed
US-11229638-B2 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. (US) 2022-01-25 US disclosed
US-11186579-B2 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. (US) 2021-11-30 US disclosed
US-11186579-B2 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. (US) 2021-11-30 US disclosed
US-11040033-B2 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. (US) 2021-06-22 US disclosed
US-11040033-B2 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. (US) 2021-06-22 US disclosed
EP-3817818-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2021-05-12 EP disclosed
CN-112384283-A Therapeutic heterocyclic compounds 吉利德科学公司 2021-02-19 CN disclosed
US-20200316035-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS GILEAD SCIENCES, INC. 2020-10-08 US disclosed
US-20200316035-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS GILEAD SCIENCES, INC. 2020-10-08 US disclosed
EP-3672970-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS Gilead Sciences, Inc. (US) 2020-07-01 EP disclosed
CN-111051305-A Therapeutic heterocyclic compounds 吉利德科学公司 2020-04-21 CN disclosed
US-20200031834-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS GILEAD SCIENCES, INC. 2020-01-30 US disclosed
US-20200031834-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS GILEAD SCIENCES, INC. 2020-01-30 US disclosed
US-20190192504-A1 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. 2019-06-27 US disclosed
US-20190192504-A1 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. 2019-06-27 US disclosed
WO-2019040102-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2019-02-28 WO disclosed
WO-2019040102-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2019-02-28 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 (6 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-11229638-B2 Therapeutic heterocyclic compounds SDHA, CYP11B2, ABCB1 NPC1 86/4885ALDH1A1 285/4885GAA 99/4885
US-20190192504-A1 Therapeutic heterocyclic compounds SDHA, CYP11B2, ABCB1 NPC1 86/4885ALDH1A1 285/4885GAA 99/4885
US-11040033-B2 Therapeutic heterocyclic compounds SDHA, CYP11B2, ABCB1 NPC1 86/4885ALDH1A1 285/4885GAA 99/4885
US-11186579-B2 Therapeutic heterocyclic compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MAPT, SLC10A1 NPC1 109/4885ALDH1A1 713/4885GAA 137/4885
US-20200316035-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS SDHA, CYP11B2, ABCB1 NPC1 86/4885ALDH1A1 285/4885GAA 99/4885
US-20200031834-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MAPT, SLC10A1 NPC1 109/4885ALDH1A1 713/4885GAA 137/4885

“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.