SCHEMBL9615422

SCHEMBL9615422

NC1=C(N)C(=Nc2ccccc2)CC=C1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ HTT P42858 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7866209 0.70 CYP2D6 (0.34) LMNAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL8755227 0.69 CYP2D6 (0.33) —
SCHEMBL18786507 0.65 ALDH1A1 (0.45) LMNAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL4799168 0.65 KMT2A (0.34) KMT2AALDH1A1
SCHEMBL11099215 0.62 LMNA (0.33) LMNAPOLBSMN1; SMN2HTTMAPK1
SCHEMBL8773370 0.60 FURIN (0.43) LMNAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL8773373 0.60 FURIN (0.43) LMNAPOLBSMN1; SMN2MEN1KMT2A
SCHEMBL1008703 0.59 ATM (0.42) POLBSMN1; SMN2MEN1KMT2AMAPT
SCHEMBL1008702 0.59 ATM (0.42) POLBSMN1; SMN2MEN1KMT2AMAPT
SCHEMBL6687850 0.59 ALDH1A1 (0.38) LMNAPOLBSMN1; SMN2MEN1KMT2A

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
JP-4139425-A — — None — — JP disclosed
JP-H04139425-A NONLINEAR OPTICAL MATERIAL NIPPON OIL & FATS CO LTD 1992-05-13 — — JP disclosed
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