SCHEMBL16805004

SCHEMBL16805004

CCOC(=O)c1ccn(C2CCCCO2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 1/20 0.44
▸ FAAH O00519 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ELANE P08246 1/20 0.38
▸ P2RY12 Q9H244 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ IDH1 O75874 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36

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
SCHEMBL29243706 0.96 RAB9A (0.43) CD274FAAHRAB9ACYP1A2NPC1
SCHEMBL24423466 0.86 KMT2A (0.47) CD274RAB9ANPC1HPGDSMN1; SMN2
SCHEMBL26916684 0.84 CD274 (0.44) CD274POLBKMT2ATDP1KDM4E
SCHEMBL23750832 0.81 CD274 (0.41) CD274RAB9ACYP1A2NPC1CYP2C9
SCHEMBL31389468 0.81 ALDH1A1 (0.46) FAAHRAB9ACYP1A2NPC1ELANE
SCHEMBL22236106 0.80 CD274 (0.44) CD274SMN1; SMN2POLBKMT2ATDP1
SCHEMBL22637340 0.79 CYP1A2 (0.44) FAAHRAB9ACYP1A2NPC1ELANE
SCHEMBL14638395 0.79 KMT2A (0.42) FAAHRAB9ACYP1A2NPC1CYP2C9
SCHEMBL16244534 0.79 CYP1A2 (0.46) FAAHRAB9ACYP1A2NPC1HPGD
SCHEMBL15754077 0.79 ACKR3 (0.42) FAAHRAB9ACYP1A2SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 — — CN disclosed
CN-116635380-A PPARgamma modulators and methods of use 卫材R&D管理有限公司 2023-08-22 — — CN disclosed
US-20230062861-A1 PPARg MODULATORS AND METHODS OF USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-03-02 — — US disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 — — WO disclosed
US-20150166505-A1 PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES Grünenthal GmbH (DE) 2015-06-18 — — US disclosed
US-20150166505-A1 PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES Grünenthal GmbH (DE) 2015-06-18 — — 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-20230062861-A1 PPARg MODULATORS AND METHODS OF USE PPARG, PPARA, PPARD CD274 4540/4885FAAH 1251/4885RAB9A 2907/4885
US-20150166505-A1 PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES AADAC, NLRP3, NOD2 CD274 4134/4885FAAH 1619/4885RAB9A 3615/4885

“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.

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