SCHEMBL17873539

SCHEMBL17873539

COc1cc(Br)c2nc(Cl)nc(N)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.41
▸ PDE8A O60658 1/20 0.39
▸ PDE5A O76074 1/20 0.33
▸ MAPT P10636 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ BCHE P06276 3/20 0.32
▸ ACHE P22303 3/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ GRM2 Q14416 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ CDK1 P06493 1/20 0.32
▸ DPP4 P27487 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
SCHEMBL11607410 0.84 KMT2A (0.43) HTTPDE8APDE5AMAPTALDH1A1
SCHEMBL17884004 0.83 KDM4E (0.33) HTTMAPTALDH1A1KDM4ENPSR1
SCHEMBL26316822 0.83 PDE8A (0.36) HTTPDE8APDE5AMAPTALDH1A1
SCHEMBL17873529 0.80 HTT (0.44) HTTPDE8AMAPTALDH1A1KDM4E
SCHEMBL17884010 0.80 HTT (0.46) HTTPDE8AALDH1A1BCHEACHE
SCHEMBL17873535 0.77 HTT (0.44) HTTPDE8ABCHEACHECDK1
SCHEMBL16689306 0.74 PDE5A (0.50) HTTPDE5ADHFR
SCHEMBL31728198 0.73 PDE5A (0.53) PDE5AKDM4E
SCHEMBL10956859 0.73 PDE5A (0.45) HTTPDE8APDE5AALDH1A1KDM4E
SCHEMBL8900322 0.72 HTT (0.58) HTTKDM4EBCHEACHECHRM1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4302830-A2 QUINAZOLINE DERIVATIVES USED TO TREAT HIV Gilead Sciences, Inc. (US) 2024-01-10 — — EP disclosed
EP-3960735-B1 QUINAZOLINE DERIVATIVES USED TO TREAT HIV GILEAD SCIENCES INC (US) 2023-09-13 — — EP disclosed
EP-3960735-B1 QUINAZOLINE DERIVATIVES USED TO TREAT HIV GILEAD SCIENCES INC (US) 2023-09-13 — — EP disclosed
US-20230043136-A1 Quinazoline Compounds INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE AS CR, V.V.I. (CZ) 2023-02-09 — — US disclosed
US-11304948-B2 Quinazoline compounds GILEAD SCIENCES, INC. (US) 2022-04-19 — — US disclosed
EP-3960735-A1 QUINAZOLINE DERIVATIVES USED TO TREAT HIV Gilead Sciences, Inc. (US) 2022-03-02 — — EP disclosed
US-20200360383-A1 Quinazoline Compounds GILEAD SCIENCES, INC. 2020-11-19 — — US disclosed
CN-111574464-A Quinazoline derivatives for the treatment of HIV 吉利德科学公司 2020-08-25 — — CN disclosed
CN-107278201-B Quinazoline derivatives for the treatment of HIV 吉利德科学公司 2020-05-19 — — CN disclosed
US-10548898-B2 Quinazoline compounds GILEAD SCIENCES INC. (US) 2020-02-04 — — US disclosed
US-20170354656-A1 Quinazoline Compounds INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE AS CR, V.V.I. (CZ) 2017-12-14 — — US disclosed
EP-3237398-A1 QUINAZOLINE DERIVATIVES USED TO TREAT HIV Gilead Sciences, Inc. (US) 2017-11-01 — — EP disclosed
US-9730936-B2 Quinazoline compounds GILEAD SCIENCES, INC. (US) 2017-08-15 — — US disclosed
US-9730936-B2 Quinazoline compounds GILEAD SCIENCES, INC. (US) 2017-08-15 — — US disclosed
US-9730936-B2 Quinazoline compounds GILEAD SCIENCES, INC. (US) 2017-08-15 — — US disclosed
US-20160250215-A1 QUINAZOLINE COMPOUNDS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE AS CR, V.V.I. (CZ) 2016-09-01 — — US disclosed
US-20160250215-A1 QUINAZOLINE COMPOUNDS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE AS CR, V.V.I. (CZ) 2016-09-01 — — US disclosed
US-20160250215-A1 QUINAZOLINE COMPOUNDS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE AS CR, V.V.I. (CZ) 2016-09-01 — — US disclosed
WO-2016105564-A1 QUINAZOLINE DERIVATIVES USED TO TREAT HIV GILEAD SCIENCES, INC. (US) 2016-06-30 — — WO disclosed
WO-2016105564-A1 QUINAZOLINE DERIVATIVES USED TO TREAT HIV GILEAD SCIENCES, INC. (US) 2016-06-30 — — 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-11304948-B2 Quinazoline compounds TTBK1, TTBK2, MAPT HTT 383/4885PDE8A 314/4885PDE5A 429/4885
US-20160250215-A1 QUINAZOLINE COMPOUNDS TTBK1, TTBK2, MAPT HTT 383/4885PDE8A 314/4885PDE5A 429/4885
US-20200360383-A1 Quinazoline Compounds TTBK1, TTBK2, MAPT HTT 383/4885PDE8A 314/4885PDE5A 429/4885
US-20230043136-A1 Quinazoline Compounds TTBK1, TTBK2, MAPT HTT 383/4885PDE8A 314/4885PDE5A 429/4885
US-10548898-B2 Quinazoline compounds TTBK1, TTBK2, MAPT HTT 383/4885PDE8A 314/4885PDE5A 429/4885
US-20170354656-A1 Quinazoline Compounds TTBK1, TTBK2, MAPT HTT 383/4885PDE8A 314/4885PDE5A 429/4885

“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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