SCHEMBL9052997

SCHEMBL9052997

C=CCc1ncnc(N2CCCCC2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
TSHR P16473 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
NPY1R P25929 1/20 0.35
HSD17B10 Q99714 1/20 0.35
POLB P06746 2/20 0.35
GBA1 P04062 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
GAA P10253 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
USP2 O75604 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL9029494 0.76 SMN1; SMN2 (0.52) MAPTMAPK1KMT2AMEN1TSHR
SCHEMBL1063993 0.75 MAPT (0.40) MAPTMAPK1KMT2AMEN1TSHR
SCHEMBL5485611 0.74 CDC7 (0.30)
SCHEMBL28256286 0.68 ALDH1A1 (0.44) KMT2AKDM4EGLAHSD17B10SMN1; SMN2
SCHEMBL17784880 0.68 ALDH1A1 (0.44) MAPTMAPK1KMT2AMEN1TSHR
SCHEMBL7951223 0.68 SLC29A1 (0.41) MAPTMAPK1KMT2AMEN1TSHR
SCHEMBL4316997 0.67 TSHR (0.59) MAPK1TSHRKDM4EHSD17B10SMN1; SMN2
Hydrochloric Acid SCHEMBL28169526 0.67 ALDH1A1 (0.43) MAPTKMT2AMEN1KDM4EGLA
SCHEMBL1703128 0.66
SCHEMBL10456578 0.66 ALDH1A1 (0.45) MAPTMAPK1TSHRHSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0345220-B1 Polyamines partially substituted by bis-piperidyl-triazines CIBA GEIGY AG (CH) 1996-08-28 EP disclosed
EP-0345221-B1 Polyamines partially substituted by piperidine-triazines CIBA GEIGY AG (CH) 1995-12-27 EP disclosed
US-4933451-A LIGHT, HEAT AND OXIDATION STABILIZERS CIBA-GEIGY CORPORATION (US) 1990-06-12 US disclosed
US-4927930-A LIGHT, HEAT AND OXIDATION STABILIZERS FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1990-05-22 US disclosed
EP-0345221-A2 Polyamines partially substituted by piperidine-triazines CIBA-GEIGY AG (CH) 1989-12-06 EP disclosed
EP-0345220-A2 Polyamines partially substituted by bis-piperidyl-triazines CIBA-GEIGY AG (CH) 1989-12-06 EP disclosed