SCHEMBL29565746

SCHEMBL29565746

N#Cc1cccc(-n2ccc3cc(C(=O)N4CCC(F)(F)CC4)cnc32)c1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.58
ADORA2A P29274 7/20 0.45
DDR1 Q08345 2/20 0.44
MGLL Q99685 1/20 0.43
CYP3A4 P08684 3/20 0.41
ALDH1A1 P00352 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
USP2 O75604 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL23675243 1.00 HPGD (0.58) HPGDADORA2ADDR1MGLLCYP3A4
SCHEMBL28887329 0.96 HPGD (0.55) HPGDADORA2ADDR1MGLLCYP3A4
SCHEMBL23680590 0.89 HPGD (0.52) HPGDADORA2ADDR1MGLLCYP3A4
SCHEMBL23675168 0.89 HPGD (0.48) HPGDADORA2ADDR1MGLL
SCHEMBL29564765 0.89 HPGD (0.48) HPGDADORA2ADDR1MGLL
SCHEMBL23680822 0.88 HPGD (0.74) HPGDADORA2AMGLLHRH3
SCHEMBL23680742 0.88 HPGD (0.59) HPGDADORA2ADDR1MGLLHRH3
SCHEMBL23675344 0.85 HPGD (0.61) HPGDDDR1MGLLCYP3A4ALDH1A1
SCHEMBL24942913 0.85 HPGD (0.61) HPGDDDR1MGLLCYP3A4USP2
SCHEMBL24942620 0.85 HPGD (0.51) HPGDADORA2ADDR1MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115335043-B PGDH inhibitors and methods of making and using the same 迈欧伏特治疗公司 2025-03-28 CN disclosed
CN-118338902-A Pyrrolo [2,3-b ] pyridine PGDH inhibitors and methods of making and using the same 埃皮里姆生物股份有限公司 2024-07-12 CN disclosed
EP-4376841-A1 PYRROLO[2,3-B]PYRIDINE PGDH INHIBITORS AND METHODS OF MAKING AND USING Epirium Bio Inc. (US) 2024-06-05 EP disclosed
CN-117377668-A Inhalant formulations of PGDH inhibitors and methods of use thereof 迈欧伏特治疗公司 2024-01-09 CN disclosed
EP-4228650-A1 INHALED FORMULATIONS OF PGDH INHIBITORS AND METHODS OF USE THEREOF Epirium Bio Inc. (US) 2023-08-23 EP disclosed
WO-2023009642-A1 PYRROLO[2,3-B]PYRIDINE PGDH INHIBITORS AND METHODS OF MAKING AND USING EPIRIUM BIO INC. (US) 2023-02-02 WO disclosed
EP-4093385-A1 PGDH INHIBITORS AND METHODS OF MAKING AND USING Myoforte Therapeutics Inc. (US) 2022-11-30 EP disclosed
CN-115335043-A PGDH inhibitors and methods of making and using 迈欧伏特治疗公司 2022-11-11 CN disclosed
WO-2022082009-A1 INHALED FORMULATIONS OF PGDH INHIBITORS AND METHODS OF USE THEREOF EPIRIUM BIO INC. (US) 2022-04-21 WO disclosed