SCHEMBL20540439

SCHEMBL20540439

Cc1c(Br)cccc1-c1cccc(-c2ccc(C=O)cc2)c1C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 4/20 0.41
PDCD1 Q15116 2/20 0.40
CD274 Q9NZQ7 2/20 0.40
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD5 P21918 1/20 0.40
DRD3 P35462 1/20 0.40
CYP2A6 P11509 3/20 0.39
ALDH1A1 P00352 5/20 0.35
ALDH1A3 P47895 1/20 0.35
BRD4 O60885 1/20 0.35
MAPK1 P28482 1/20 0.34
PTGS1 P23219 1/20 0.33
S1PR1 P21453 1/20 0.33
ELANE P08246 1/20 0.33
TYR P14679 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
SCHEMBL20540212 0.97 DRD1 (0.42) DRD1PDCD1CD274DRD2DRD4
SCHEMBL21507018 0.88 DRD1 (0.40) DRD1PDCD1CD274DRD2DRD4
SCHEMBL30498620 0.82 DRD1 (0.49) DRD1PDCD1CD274DRD2DRD4
SCHEMBL20294451 0.82 DRD1 (0.49) DRD1PDCD1CD274DRD2DRD4
SCHEMBL23783646 0.80 ALDH1A1 (0.47) ALDH1A1ALDH1A3BRD4MAPK1ELANE
SCHEMBL28602844 0.79 DRD1 (0.42) DRD1PDCD1CD274DRD2DRD4
SCHEMBL30704990 0.79 DRD1 (0.42) DRD1PDCD1CD274DRD2DRD4
SCHEMBL5964342 0.79 CYP2A6 (0.45) DRD1PDCD1CD274DRD2DRD4
SCHEMBL8176332 0.78 ALDH1A1 (0.58) DRD1DRD2DRD4DRD5DRD3
SCHEMBL23783663 0.76 ALDH1A1 (0.40) CYP2A6ALDH1A1ALDH1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590062-B2 PD-1/PD-L1 inhibitors GILEAD SCIENCES, INC. (US) 2026-03-31 US disclosed
EP-4688777-A1 NOVEL PD-L1 INHIBITORS Affirma Biotech S. L. (ES) 2026-02-11 EP disclosed
EP-4600247-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2025-08-13 EP disclosed
EP-3781556-B1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES INC (US) 2025-06-18 EP disclosed
WO-2024200308-A1 NOVEL PD-L1 INHIBITORS Affirma Biotech S. L. (ES) 2024-10-03 WO disclosed
EP-4434987-A1 NOVEL PD-L1 INHIBITORS Affirma Biotech S. L. (ES) 2024-09-25 EP disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
EP-3612525-B1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES INC (US) 2021-10-27 EP disclosed
US-20210323922-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-10-21 US disclosed
US-10899735-B2 PD-1/PD-L1 inhibitors GILEAD SCIENCES, INC. (US) 2021-01-26 US disclosed
US-20190345131-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2019-11-14 US disclosed
WO-2019204609-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2019-10-24 WO disclosed
US-20180305315-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2018-10-25 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 (5 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-20210323922-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 DRD1 3853/4885PDCD1 2/4885CD274 1/4885
US-10899735-B2 PD-1/PD-L1 inhibitors PDCD1, CD274, PDCD1LG2 DRD1 4247/4885PDCD1 1/4885CD274 2/4885
US-20190345131-A1 PD-1/PD-L1 INHIBITORS PDCD1, CD274, PDCD1LG2 DRD1 4247/4885PDCD1 1/4885CD274 2/4885
US-12590062-B2 PD-1/PD-L1 inhibitors CD274, PDCD1LG2, PDCD1 DRD1 989/4885PDCD1 3/4885CD274 1/4885
US-20180305315-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 DRD1 3853/4885PDCD1 2/4885CD274 1/4885

“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.