SCHEMBL28972985

SCHEMBL28972985

CC(C)(C)c1cc(C(C)(C(=O)O)n2nc3ccccc3n2)ccc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 7/20 0.40
HSP90AB1 P08238 7/20 0.40
RARB P10826 2/20 0.39
RARG P13631 2/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
NR1I2 O75469 1/20 0.38
CYP2C9 P11712 1/20 0.38
MIF P14174 1/20 0.38
TYR P14679 1/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
NFE2L2 Q16236 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ESRRA P11474 2/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
PPARG P37231 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
SCHEMBL27510293 0.79 NPSR1 (0.40) HSP90AA1ALDH1A1LMNAHSD17B10TSHR
SCHEMBL3761349 0.79 HSP90AA1 (0.38) HSP90AA1HSP90AB1RARBRARGALDH1A1
SCHEMBL11687158 0.72 ALDH1A1 (0.52) HSP90AA1HSP90AB1RARBRARGALDH1A1
SCHEMBL11361036 0.72 ALDH1A1 (0.52) HSP90AA1HSP90AB1RARBRARGALDH1A1
Bicarbonate SCHEMBL18315853 0.71 ALDH1A1 (0.57) HSP90AA1HSP90AB1RARBRARGALDH1A1
Benzene SCHEMBL28155736 0.71 ALDH1A1 (0.61) HSP90AA1HSP90AB1RARBRARGALDH1A1
SCHEMBL27493345 0.70 ALDH1A1 (0.50) HSP90AA1HSP90AB1RARBRARGALDH1A1
SCHEMBL2836826 0.70 HSP90AA1 (0.38) HSP90AA1HSP90AB1RARBRARGALDH1A1
Acetic Acid SCHEMBL11229210 0.70 ALDH1A1 (0.55) HSP90AA1HSP90AB1RARBRARGALDH1A1
SCHEMBL7917289 0.70 ALDH1A1 (0.53) HSP90AA1HSP90AB1RARBRARGALDH1A1

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
CN-119947395-A Ultraviolet absorption layer, preparation method thereof, perovskite solar cell and photovoltaic module 天合光能股份有限公司 2025-05-06 CN disclosed
CN-112204065-B Process for preparing polyisocyanate polymers and polyisocyanurate plastics 科思创知识产权两合公司 2023-03-28 CN disclosed