SCHEMBL13325783

SCHEMBL13325783

Cc1cn2cc(-c3ccccc3)nc2cc1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 8/20 0.59
▸ RAB9A P51151 8/20 0.59
▸ ALDH1A1 P00352 7/20 0.59
▸ KDM4E B2RXH2 6/20 0.59
▸ SMN1; SMN2 Q16637 5/20 0.59
▸ HPGD P15428 4/20 0.59
▸ TP53 P04637 3/20 0.59
▸ TSHR P16473 2/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ PKM P14618 2/20 0.59
▸ CDK5 Q00535 1/20 0.59
▸ CDK5R1 Q15078 1/20 0.59
▸ ALDH1A3 P47895 8/20 0.56
▸ SLC2A1 P11166 1/20 0.56
▸ ALDH1A2 O94788 2/20 0.54
▸ TLR9 Q9NR96 1/20 0.52
▸ PLK4 O00444 1/20 0.51
▸ JAK2 O60674 1/20 0.51
▸ RET P07949 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
SCHEMBL13325784 0.95 ALDH1A3 (0.64) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL13325794 0.92 NPC1 (0.55) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL13325788 0.92 ALDH1A3 (0.62) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL13325789 0.90 ALDH1A3 (0.50) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL15417672 0.87 NPC1 (0.63) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL12920736 0.85 RAB9A (0.41) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL19389851 0.83 NPC1 (0.55) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL13325785 0.80 NPC1 (0.65) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL6393875 0.79 SMN1; SMN2 (0.79) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL13325715 0.78 NPC1 (0.52) NPC1RAB9AALDH1A1KDM4ESMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714319-B2 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2010-05-11 — — US disclosed
US-7714319-B2 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2010-05-11 — — US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 — — US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 — — US disclosed
Send feedback