Tetrahydrofuran

Tetrahydrofuran

SCHEMBL1775706

C1CCOC1.CCCO.CCO.CO

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Tetrahydrofuran. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TSHR P16473 1/20 0.33
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
Tetrahydrofuran SCHEMBL3093521 0.94
Propanol SCHEMBL11328156 0.92 ALDH1A1 (0.47) ALDH1A1TSHRKDM4ESMN1; SMN2
Tetrahydrofuran SCHEMBL27635431 0.92 ALDH1A1 (0.47) ALDH1A1TSHRKDM4ESMN1; SMN2
Tetrahydrofuran SCHEMBL218583 0.91 ALDH1A1 (0.53) ALDH1A1TSHR
Alcohol SCHEMBL7807841 0.88 ALDH1A1 (0.50) ALDH1A1TSHR
Tetrahydrofuran SCHEMBL30232 0.88
Tetrahydrofuran SCHEMBL8412489 0.88 ALDH1A1 (0.57) ALDH1A1TSHRKDM4E
Tetrahydrofuran SCHEMBL2513702 0.86 ALDH1A1 (0.42) ALDH1A1KDM4E
Alcohol SCHEMBL4270003 0.85 ALDH1A1 (0.53) ALDH1A1TSHR
Tetrahydrofuran SCHEMBL241626 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943115-B2 Hydrotreating catalyst and/or carrier; heat stability; desulfurization and denitrogenation of hydrocarbon oils; prepared using particle growth inhibiter CHIYODA CORPORATION (JP) 2011-05-17 US disclosed
US-20040238410-A1 Porous 4 group metal oxide and method for preparation thereof CHIYODA CORPORATION (JP) 2004-12-02 US disclosed