SCHEMBL9505445

SCHEMBL9505445

CC(C)c1ccc(-c2ccc(OCC(=O)O)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.66
TSHR P16473 1/20 0.66
RAB9A P51151 2/20 0.55
MAPT P10636 2/20 0.54
NPC1 O15118 1/20 0.54
ALOX15 P16050 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
RXRA P19793 1/20 0.53
RXRB P28702 1/20 0.53
SRD5A2 P31213 1/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.51
FKBP1A P62942 1/20 0.51

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
SCHEMBL801233 0.95 ALDH1A1 (0.72) ALDH1A1TSHRRAB9AMAPTNPC1
Formaldehyde SCHEMBL28601398 0.91 ALDH1A1 (0.68) ALDH1A1TSHRRAB9AMAPTNPC1
SCHEMBL22932078 0.86 ALDH1A1 (0.50) ALDH1A1TSHRRAB9AMAPTNPC1
SCHEMBL5959416 0.85 PPARD (0.51) ALDH1A1TSHRRAB9ARXRARXRB
SCHEMBL2780802 0.85 ALOX15 (0.71) ALDH1A1TSHRRAB9AMAPTNPC1
SCHEMBL8302859 0.80 RAB9A (0.59) ALDH1A1TSHRRAB9AMAPTNPC1
SCHEMBL421532 0.80 L3MBTL1 (0.59) ALDH1A1TSHRMAPTALOX15SMN1; SMN2
SCHEMBL4011865 0.80 MAP4K4 (0.65) ALDH1A1MAPTALOX15SMN1; SMN2KMT2A
SCHEMBL25146826 0.80 ALDH1A1 (0.54) ALDH1A1TSHRMAPTALOX15SMN1; SMN2
SCHEMBL422442 0.80 ALOX15 (0.76) ALDH1A1RAB9AMAPTNPC1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0324917-B1 LOW PLATE-OUT POLYCARBONATES GENERAL ELECTRIC COMPANY (US) 1993-06-30 EP disclosed
US-4950782-A Low plate-out polycarbonates GENERAL ELECTRIC COMPANY (US) 1990-08-21 US disclosed
US-4841015-A Low plate-out polycarbonate end capped with phenoxy acetic acid GENERAL ELECTRIC COMPANY (US) 1989-06-20 US disclosed