SCHEMBL20007534

SCHEMBL20007534

CC(C)(C)c1ccc(Oc2ccc(C(C)(C)c3ccc(Oc4ccc(S(=O)(=O)C(C)(C)C)cc4)cc3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.70
MAPT P10636 3/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
HPGD P15428 2/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 5/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
LMNA P02545 5/20 0.41
HTT P42858 4/20 0.41
MEN1 O00255 1/20 0.40
RECQL P46063 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 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
SCHEMBL18601802 0.95 ALDH1A1 (0.78) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL19365941 0.90 ALDH1A1 (0.70) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL19117449 0.90 ALDH1A1 (0.70) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL19365943 0.86 ALDH1A1 (0.64) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL10034520 0.84 ALDH1A1 (1.00) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL19365942 0.82 ALDH1A1 (0.58) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL10000947 0.82 MAPT (0.68) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL8941594 0.81 PTPRZ1 (0.50) ALDH1A1NPC1RAB9AMAPK1SMN1; SMN2
SCHEMBL19362023 0.81 HTT (0.57) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL10000946 0.80 ALDH1A1 (0.57) ALDH1A1MAPTNPC1RAB9AHPGD

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-20240226816-A1 CO2 GAS ENRICHMENT METHOD KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2024-07-11 US disclosed
EP-2843743-B1 Membrane electrode units for high temperature fuel cells with improved stability BASF SE (DE) 2018-03-28 EP disclosed