SCHEMBL9706088

SCHEMBL9706088

Cc1cc2nc3c4cc(Br)ccc4n(CCN(C)C)c3nc2cc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.50
ALOX15 P16050 2/20 0.50
POLB P06746 3/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
RAD52 P43351 1/20 0.43
SMARCA2 P51531 1/20 0.43
TOP2A P11388 1/20 0.42
TERT O14746 1/20 0.41
MAPT P10636 9/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
CREBBP Q92793 1/20 0.40
DNM1 Q05193 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 2/20 0.39
NR1I2 O75469 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
SCHEMBL9706156 0.90 MAPK1 (0.50) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL9706137 0.89 MAPK1 (0.63) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL9706117 0.87 MAPK1 (0.47) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL24176382 0.85 POLB (0.43) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL1232971 0.85 WEE1 (0.44) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL30297105 0.85 WEE1 (0.44) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL7636415 0.85 POLB (0.43) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL30297110 0.85 POLB (0.43) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL1581068 0.84 POLB (0.61) MAPK1ALOX15POLBRAB9ANPC1
SCHEMBL30297107 0.84 POLB (0.61) MAPK1ALOX15POLBRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238459-B1 SUBSTITUTED INDOLOQUINOXALINES Lundblad, Leif (SE) 1992-04-15 EP claimed
WO-1987004436-A1 SUBSTITUTED INDOLOQUINOXALINES LUNDBLAD, LEIF (SE) 1987-07-30 WO claimed
EP-4171561-A1 6H-INDOLO[2,3-B]QUINOXALINE DERIVATIVES USEFUL IN THERAPY Vironova Medical AB (SE) 2023-05-03 EP disclosed
EP-0238459-B1 SUBSTITUTED INDOLOQUINOXALINES Lundblad, Leif (SE) 1992-04-15 EP disclosed
US-4990510-A Viricides, anticancer agents LEIF LUNDBLAD (BE) 1991-02-05 US disclosed