SCHEMBL2655671

SCHEMBL2655671

CC(C)OCc1ccc2c(c1)ncn2-c1cccc(-c2cccs2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 8/20 0.43
KDM4E B2RXH2 3/20 0.40
NPC1 O15118 3/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 3/20 0.40
MAPT P10636 3/20 0.40
HPGD P15428 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
RAB9A P51151 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
GAA P10253 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PLK1 P53350 1/20 0.39
PLK3 Q9H4B4 1/20 0.39

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
SCHEMBL2655655 0.90 FGFR1 (0.46) FGFR1KDM4ENPC1ALDH1A1LMNA
SCHEMBL5929816 0.88 FGFR1 (0.42) FGFR1KDM4ENPC1ALDH1A1LMNA
SCHEMBL2654500 0.86 FGFR1 (0.45) FGFR1KDM4ENPC1ALDH1A1LMNA
SCHEMBL2661821 0.85 FGFR1 (0.40) FGFR1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2654570 0.84 HPGD (0.43) FGFR1KDM4ENPC1ALDH1A1LMNA
SCHEMBL2659740 0.82 HPGD (0.38) FGFR1KDM4ENPC1ALDH1A1LMNA
SCHEMBL2662068 0.81 FGFR1 (0.40) FGFR1ALDH1A1HPGDGABRA1GABRG2
SCHEMBL2653433 0.80 NT5E (0.41) FGFR1ALDH1A1HPGDGABRA1GABRG2
SCHEMBL2652633 0.79 FGFR1 (0.46) FGFR1ALDH1A1HPGD
SCHEMBL2662575 0.78 FGFR1 (0.45) FGFR1ALDH1A1HPGDKDR

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-20060069135-A1 Benzimidazole derivatives and their use for modulating the gaba-a receptor complex NEUROSEARCH A/S (DK) 2006-03-30 US claimed
US-20060069135-A1 Benzimidazole derivatives and their use for modulating the gaba-a receptor complex NEUROSEARCH A/S (DK) 2006-03-30 US disclosed
EP-1613618-A2 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABA- sb A /sb RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2006-01-11 EP disclosed
WO-2004087690-A2 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABA-A RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2004-10-14 WO 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 (1 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-20060069135-A1 Benzimidazole derivatives and their use for modulating the gaba-a receptor complex GABRB2, GABRB1, GABRB3 FGFR1 3374/4885KDM4E 1815/4885NPC1 1700/4885

“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.