SCHEMBL20980751

SCHEMBL20980751

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nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 1/20 0.36
HDAC1 Q13547 1/20 0.32
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
FPR2 P25090 1/20 0.32
CYP2D6 P10635 2/20 0.31
CYP2C19 P33261 2/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL19764845 1.00 NAALAD2 (0.36) NAALAD2HDAC1TSHRALDH1A1FPR2
SCHEMBL25761623 1.00 NAALAD2 (0.36) NAALAD2HDAC1TSHRALDH1A1FPR2
SCHEMBL23373592 0.83 RNPEP (0.35) NAALAD2HDAC1ALDH1A1FPR2
SCHEMBL25870207 0.83 RNPEP (0.35) NAALAD2HDAC1ALDH1A1FPR2
SCHEMBL16750132 0.82 TSHR (0.38) NAALAD2TSHRALDH1A1FPR2CYP2D6
SCHEMBL22891945 0.78 DGAT1 (0.34)
SCHEMBL26996992 0.78 DGAT1 (0.34)
SCHEMBL22891947 0.75 TSHR (0.33) TSHR
SCHEMBL21507151 0.74 CYP2D6 (0.41) NAALAD2HDAC1ALDH1A1FPR2CYP2D6
SCHEMBL24613313 0.74 CYP2D6 (0.41) NAALAD2HDAC1ALDH1A1FPR2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11872217-B2 Indanes as PD-L1 inhibitors CHEMOCENTRYX, INC. (US) 2024-01-16 US disclosed
US-20230331675-A1 AROMATIC ETHYLENE COMPOUND AND PREPARATION METHOD THEREFOR, AND INTERMEDIATE, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF GUANGZHOU MAXINOVEL PHARMACEUTICALS CO., LTD. (CN) 2023-10-19 US disclosed
US-20230212155-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-11135210-B2 Indane-amines as PD-L1 antagonists CHEMOCENTRYX, INC. (US) 2021-10-05 US disclosed
US-10919852-B2 Immunomodulator compounds CHEMOCENTRYX, INC. (US) 2021-02-16 US disclosed
US-20200375962-A1 INDANE-AMINES AS PD-L1 ANTAGONISTS CHEMOCENTRYX, INC. 2020-12-03 US disclosed
US-20190135745-A1 IMMUNOMODULATOR COMPOUNDS CHEMOCENTRYX, INC. 2019-05-09 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 (7 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-20190135745-A1 IMMUNOMODULATOR COMPOUNDS IL2, FCGRT, IFNG NAALAD2 1983/4885HDAC1 509/4885TSHR 352/4885
US-20230212155-A1 PD-1/PD-L1 INHIBITORS PDCD1, CD274, PDCD1LG2 NAALAD2 2997/4885HDAC1 159/4885TSHR 2425/4885
US-20200375962-A1 INDANE-AMINES AS PD-L1 ANTAGONISTS CD274, PDCD1LG2, PDCD1 NAALAD2 3873/4885HDAC1 415/4885TSHR 146/4885
US-11872217-B2 Indanes as PD-L1 inhibitors CD274, PDCD1, PDCD1LG2 NAALAD2 3718/4885HDAC1 208/4885TSHR 239/4885
US-11135210-B2 Indane-amines as PD-L1 antagonists CD274, PDCD1LG2, PDCD1 NAALAD2 3873/4885HDAC1 415/4885TSHR 146/4885
US-20230331675-A1 AROMATIC ETHYLENE COMPOUND AND PREPARATION METHOD THEREFOR, AND INTERMEDIATE, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF PDCD1, CD274, PDCD1LG2 NAALAD2 4098/4885HDAC1 1813/4885TSHR 3202/4885
US-10919852-B2 Immunomodulator compounds IL2, FCGRT, IFNG NAALAD2 1983/4885HDAC1 509/4885TSHR 352/4885

“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.