SCHEMBL22480888

SCHEMBL22480888

COC(=O)c1cccc(COc2ccc(Cl)cc2Cl)c1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 15/20 0.74
SMN1; SMN2 Q16637 5/20 0.65
NPC1 O15118 4/20 0.65
RAB9A P51151 4/20 0.65
ALDH1A1 P00352 3/20 0.65
HPGD P15428 2/20 0.65
MAPT P10636 2/20 0.65
HTT P42858 2/20 0.65
MDM2 Q00987 1/20 0.65
GPR55 Q9Y2T6 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
KDM4E B2RXH2 1/20 0.57
TP53 P04637 1/20 0.57
XBP1 P17861 1/20 0.57
HSD17B10 Q99714 1/20 0.57
THRB P10828 1/20 0.56

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
SCHEMBL4510288 0.90 MRGPRX4 (0.74) MRGPRX4SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL692883 0.90 MRGPRX4 (0.66) MRGPRX4SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL26162589 0.89 MRGPRX4 (0.77) MRGPRX4SMN1; SMN2THRB
SCHEMBL15235340 0.88 MRGPRX4 (0.70) MRGPRX4SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22469924 0.86 MRGPRX4 (0.58) MRGPRX4SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22480715 0.85 MRGPRX4 (1.00) MRGPRX4SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22480902 0.85 MRGPRX4 (0.74) MRGPRX4SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL15227963 0.84 MRGPRX4 (0.66) MRGPRX4SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL22469980 0.84 MRGPRX4 (1.00) MRGPRX4
SCHEMBL22480877 0.84 MRGPRX4 (1.00) MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11840521-B2 Modulators of Mas-related G-protein receptor X4 and related products and methods ESCIENT PHARMACEUTICALS, INC. (US) 2023-12-12 US disclosed
US-11840521-B2 Modulators of Mas-related G-protein receptor X4 and related products and methods ESCIENT PHARMACEUTICALS, INC. (US) 2023-12-12 US disclosed
US-20230159474-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS INCYTE CORPORATION 2023-05-25 US disclosed
US-20230159474-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS INCYTE CORPORATION 2023-05-25 US disclosed
US-11643399-B2 Modulators of mas-related G-protein receptor X4 and related products and methods ESCIENT PHARMACEUTICALS, INC. (US) 2023-05-09 US disclosed
US-11643399-B2 Modulators of mas-related G-protein receptor X4 and related products and methods ESCIENT PHARMACEUTICALS, INC. (US) 2023-05-09 US disclosed
US-20230053860-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS INCYTE CORPORATION 2023-02-23 US disclosed
US-20210032213-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS INCYTE CORPORATION 2021-02-04 US disclosed
CN-110128299-B Diphenylurea antitumor small-molecule inhibitor and preparation method thereof 浙江大学 2020-11-10 CN disclosed
WO-2020198537-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS ESCIENT PHARMACEUTICALS, INC. (US) 2020-10-01 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 (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-11840521-B2 Modulators of Mas-related G-protein receptor X4 and related products and methods MRGPRX4, MRGPRX1, MRGPRX2 MRGPRX4 1/4885SMN1; SMN2 4483/4885NPC1 809/4885
US-11643399-B2 Modulators of mas-related G-protein receptor X4 and related products and methods MRGPRX4, MRGPRX1, MRGPRX2 MRGPRX4 1/4885SMN1; SMN2 4483/4885NPC1 809/4885
US-20210032213-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS MRGPRX4, MRGPRX1, MRGPRX2 MRGPRX4 1/4885SMN1; SMN2 4469/4885NPC1 813/4885
US-20230159474-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS MRGPRX4, MRGPRX1, MRGPRX2 MRGPRX4 1/4885SMN1; SMN2 4483/4885NPC1 809/4885
US-20230053860-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS MRGPRX4, MRGPRX1, MRGPRX2 MRGPRX4 1/4885SMN1; SMN2 4483/4885NPC1 809/4885

“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.