SCHEMBL25340705

SCHEMBL25340705

O=C(O)c1cc(Br)cc(O)c1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.53
AKR1C2 P52895 2/20 0.53
AKR1C1 Q04828 2/20 0.53
AKR1C4 P17516 1/20 0.53
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 3/20 0.42
GLA P06280 1/20 0.42
HPGD P15428 3/20 0.41
CYP2C9 P11712 2/20 0.41
ALOX15 P16050 2/20 0.41
CASP1 P29466 2/20 0.41
CYP2C19 P33261 2/20 0.41
CES2 O00748 1/20 0.41
GALR3 O60755 1/20 0.41
CYP1A2 P05177 1/20 0.41
CA1 P00915 5/20 0.38
CA2 P00918 5/20 0.38
CA12 O43570 4/20 0.38
CA7 P43166 4/20 0.38
CA9 Q16790 4/20 0.38

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
SCHEMBL29509769 1.00 AKR1C3 (0.53) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10
SCHEMBL16098563 0.87 AKR1C3 (0.56) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10
SCHEMBL29209706 0.82 DGAT1 (0.48) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10
SCHEMBL30881873 0.82 DGAT1 (0.48) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10
SCHEMBL671102 0.81 AKR1C2 (0.50) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10
SCHEMBL5854041 0.81 AKR1C3 (0.61) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10
SCHEMBL30300276 0.81 AKR1C2 (0.50) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10
SCHEMBL15524528 0.78 CA1 (0.50) HSD17B10KDM4EHPGDCYP2C9ALOX15
SCHEMBL8285504 0.78 AKR1C3 (0.69) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10
SCHEMBL31068478 0.78 AKR1C3 (0.69) AKR1C3AKR1C2AKR1C1AKR1C4HSD17B10

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
CN-118026880-A Aryl amide compound, pharmaceutical composition containing same and application thereof 华东师范大学 2024-05-14 CN disclosed
US-20240034736-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. 2024-02-01 US disclosed
CN-116744918-A HSD17B13 inhibitors and uses thereof FL2022-001公司 2023-09-12 CN disclosed
EP-4221702-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, Inc. (US) 2023-08-09 EP disclosed
EP-4223751-A1 BENZAMIDE COMPOUND AND USE THEREOF Humanwell Healthcare (Group) Co., Ltd. (CN) 2023-08-09 EP disclosed
US-20230227445-A1 BENZAMIDE COMPOUND AND USE THEREOF HUMANWELL HEALTHCARE (GROUP) CO., LTD. (CN) 2023-07-20 US disclosed
US-20230227445-A1 BENZAMIDE COMPOUND AND USE THEREOF HUMANWELL HEALTHCARE (GROUP) CO., LTD. (CN) 2023-07-20 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 (2 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-20230227445-A1 BENZAMIDE COMPOUND AND USE THEREOF P2RX3, P2RX4, P2RX7 AKR1C3 1283/4885AKR1C2 1649/4885AKR1C1 1540/4885
US-20240034736-A1 HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B11, HSD17B1 AKR1C3 152/4885AKR1C2 166/4885AKR1C1 244/4885

“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.