SCHEMBL9876152

SCHEMBL9876152

Cc1cccc(-c2ccc3cc(C(C)C)cccc2-3)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.46
RXRB P28702 1/20 0.46
RXRG P48443 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
ENPP3 O14638 1/20 0.42
LMNA P02545 1/20 0.41
JAK2 O60674 1/20 0.40
PTPN5 P54829 1/20 0.40
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
PDK2 Q15119 1/20 0.40
NR4A2 P43354 1/20 0.40
EPHX1 P07099 1/20 0.39
CNR2 P34972 2/20 0.39
NPC1 O15118 2/20 0.39
ALDH1A1 P00352 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PGR P06401 1/20 0.39

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
SCHEMBL9875654 0.85 RXRA (0.53) RXRARXRBRXRGAKR1C3AKR1C2
SCHEMBL9177215 0.85 RXRA (0.50) RXRARXRBRXRGLMNAPTPN5
SCHEMBL9876346 0.81 RXRA (0.45) RXRARXRBRXRGLMNAPTPN5
SCHEMBL9875662 0.79 LMNA (0.55) RXRARXRBRXRGLMNAPTPN5
SCHEMBL9876129 0.79 CNR2 (0.51) AKR1C3AKR1C2ENPP3PDK2CNR2
SCHEMBL6915406 0.79 RXRA (0.53) RXRARXRBRXRGLMNAJAK2
SCHEMBL9874684 0.79 ATM (0.44) RXRARXRBRXRGLMNAJAK2
SCHEMBL29352930 0.78 ACHE (0.55) RXRARXRBRXRGLMNAJAK2
SCHEMBL99347 0.78 ACHE (0.55) RXRARXRBRXRGLMNAJAK2
SCHEMBL5490186 0.78 ACHE (0.55) RXRARXRBRXRGLMNAJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed