SCHEMBL20539615

SCHEMBL20539615

O=C1c2cccc(Cl)c2CC1F

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.40
AADAT Q8N5Z0 1/20 0.38
NOTUM Q6P988 1/20 0.37
MAPK14 Q16539 2/20 0.35
S100A4 P26447 2/20 0.35
MAPT P10636 1/20 0.35
NSD2 O96028 2/20 0.34
BCHE P06276 1/20 0.34
DAO P14920 1/20 0.34
CES1 P23141 1/20 0.34
CYP19A1 P11511 2/20 0.34
TP53 P04637 1/20 0.33
RECQL P46063 1/20 0.33
METAP1 P53582 1/20 0.33
SMARCA2 P51531 1/20 0.33
SMARCA4 P51532 1/20 0.33
PBRM1 Q86U86 1/20 0.33
BRD4 O60885 1/20 0.32
CREBBP Q92793 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
SCHEMBL16556014 0.79 ACHE (0.41) ACHEAADATCYP19A1METAP1
SCHEMBL28725626 0.78 CYP19A1 (0.54) ACHEMAPTCYP19A1TP53RECQL
SCHEMBL28725627 0.78 CYP19A1 (0.54) ACHEMAPTCYP19A1TP53RECQL
SCHEMBL1453411 0.78 ACHE (0.66) ACHEAADATNOTUMMAPK14S100A4
SCHEMBL19764906 0.78 CDK5 (0.44) ACHES100A4CYP19A1METAP1
SCHEMBL8558933 0.78 ACHE (0.40) ACHEAADATNOTUMMAPK14S100A4
SCHEMBL30666419 0.78 ACHE (0.40) ACHEAADATNOTUMMAPK14S100A4
SCHEMBL5952927 0.77 METAP1 (0.37) ACHEAADATNOTUMMAPK14S100A4
SCHEMBL5951729 0.74 CYP19A1 (0.45) ACHES100A4MAPTBCHECYP19A1
SCHEMBL5952358 0.74 ACHE (0.40) ACHEAADATNOTUMMAPK14S100A4

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-12590062-B2 PD-1/PD-L1 inhibitors GILEAD SCIENCES, INC. (US) 2026-03-31 US disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
US-20210323922-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-10-21 US disclosed
US-20210323922-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-10-21 US disclosed
CN-110799509-A PD-1/PD-L1 inhibitors 吉利德科学公司 2020-02-14 CN 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 (3 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 ACHE 3876/4885AADAT 3923/4885NOTUM 3868/4885
US-12590062-B2 PD-1/PD-L1 inhibitors CD274, PDCD1LG2, PDCD1 ACHE 4256/4885AADAT 4344/4885NOTUM 4444/4885
US-20180305315-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 ACHE 3876/4885AADAT 3923/4885NOTUM 3868/4885

“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.