SCHEMBL10072935

SCHEMBL10072935

CC1CC(c2ccccc2)=NN1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.51
NISCH Q9Y2I1 1/20 0.43
AXL P30530 1/20 0.40
MAOA P21397 4/20 0.40
MAOB P27338 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 4/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
HIF1A Q16665 1/20 0.39
HTT P42858 1/20 0.36
LMNA P02545 1/20 0.36
KDM4E B2RXH2 2/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 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
SCHEMBL14538096 0.76 AXL (0.40) RAB9AAXLMAOAMAOBSMN1; SMN2
SCHEMBL10047434 0.76 RAB9A (0.37) RAB9AAXLMAOAMAOBSMN1; SMN2
SCHEMBL14039448 0.76 RAB9A (0.43) RAB9AAXLMAOAMAOBSMN1; SMN2
SCHEMBL6268223 0.74 MAOA (0.57) RAB9AAXLMAOAMAOBSMN1; SMN2
SCHEMBL27685976 0.74 RAB9A (0.40) RAB9ANISCHAXLMAOAMAOB
SCHEMBL14922983 0.73 DRD1 (0.38) RAB9AALDH1A1LMNAGAAMEN1
SCHEMBL27475373 0.72 AXL (0.41) RAB9AAXLMAOAMAOBSMN1; SMN2
SCHEMBL11129830 0.72 RAB9A (0.43) RAB9AAXLMAOAMAOBSMN1; SMN2
SCHEMBL1754736 0.71 GPR119 (0.61) RAB9AAXLSMN1; SMN2ALDH1A1HTT
SCHEMBL28299833 0.69 NISCH (0.44) RAB9ANISCHMAOAMAOBSMN1; SMN2

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
US-8445681-B2 Azaindazoles useful as inhibitors of kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-05-21 US disclosed
US-20120165367-A1 AZAINDAZOLES USEFUL AS INHIBITORS OF KINASES VERTEX PHARMACEUTICALS INCORPORATED 2012-06-28 US disclosed
US-20070179177-A1 Azaindazoles useful as inhibitors of kinases VERTEX PHARMACEUTICALS INCORPORATED 2007-08-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070179177-A1 Azaindazoles useful as inhibitors of kinases PRKDC, MAP3K20, PRKACA RAB9A 2522/4885NISCH 1403/4885AXL 1189/4885
US-20120165367-A1 AZAINDAZOLES USEFUL AS INHIBITORS OF KINASES PRKDC, MAP3K20, PRKACA RAB9A 2522/4885NISCH 1403/4885AXL 1189/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.