SCHEMBL20534347

SCHEMBL20534347

N#Cc1nn(Cc2cccnc2)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.48
SNCA P37840 3/20 0.48
CHRM1 P11229 1/20 0.46
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
GUSB P08236 1/20 0.43
CCNT1 O60563 2/20 0.42
CDK1 P06493 2/20 0.42
CCNB1 P14635 2/20 0.42
CDK9 P50750 2/20 0.42
P2RX7 Q99572 1/20 0.42
CYP11B2 P19099 1/20 0.41
ALOX5 P09917 1/20 0.41
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
ELANE P08246 1/20 0.41
ACHE P22303 1/20 0.41
SRC P12931 1/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 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
SCHEMBL28253344 0.86 ELANE (0.43) APPSNCACHRM1ALDH1A1CNR1
SCHEMBL4435378 0.86 CNR1 (0.54) CHRM1ALDH1A1CNR1CNR2ELANE
SCHEMBL20534349 0.85 CNR1 (0.43) CHRM1ALDH1A1CNR1CNR2ELANE
SCHEMBL20534644 0.84 GRIN1 (0.43) ALDH1A1PKMP2RX7CYP11B2SRC
SCHEMBL23162012 0.80 P2RX7 (0.42) APPSNCACHRM1ALDH1A1PKM
SCHEMBL28252589 0.80 P2RX7 (0.42) APPSNCAALDH1A1PKMP2RX7
SCHEMBL19328149 0.79 CNR1 (0.43) CHRM1ALDH1A1CNR1CNR2ELANE
SCHEMBL27625118 0.79 ALDH1A1 (0.54) APPSNCACHRM1ALDH1A1PKM
SCHEMBL20140445 0.78 ELANE (0.41) CHRM1ALDH1A1CNR1CNR2ELANE
SCHEMBL14853614 0.78 PTGER4 (0.47) APPSNCAALDH1A1CNR1CNR2

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
EP-3609883-A1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2020-02-19 EP disclosed
WO-2018188590-A1 FLUORINE-SUBSTITUTED INDAZOLE COMPOUNDS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2018-10-18 WO disclosed