SCHEMBL714570

SCHEMBL714570

[c]1ccccc1-c1cc(-c2ccccc2)ncn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 0.50
MIF P14174 1/20 0.50
KMO O15229 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 3/20 0.41
TSHR P16473 2/20 0.41
RECQL P46063 1/20 0.41
HRH4 Q9H3N8 1/20 0.40
MAPT P10636 3/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
SMO Q99835 1/20 0.38
MEN1 O00255 2/20 0.37

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
SCHEMBL284286 0.80 ASIC3 (0.71) ASIC3MIFKMOSMN1; SMN2NPC1
SCHEMBL712320 0.79 CYP1A2 (0.33) ASIC3MIFCYP1A2CYP2C19TSHR
SCHEMBL28218682 0.78 ASIC3 (0.68) ASIC3MIFKMOSMN1; SMN2NPC1
SCHEMBL27904874 0.78 ASIC3 (0.68) ASIC3MIFKMOSMN1; SMN2NPC1
SCHEMBL29406194 0.78 ASIC3 (0.68) ASIC3MIFKMOSMN1; SMN2NPC1
SCHEMBL9958776 0.78 MEN1 (0.48) SMN1; SMN2RAB9AKMT2ATSHRMAPT
SCHEMBL28575562 0.77 ASIC3 (0.41) ASIC3CYP1A2CYP2C9CYP2C19SMO
SCHEMBL28917951 0.77 ASIC3 (0.49) ASIC3MIFNPC1RAB9AMAPT
SCHEMBL714571 0.77 ASIC3 (0.57) ASIC3MIFKMOSMN1; SMN2NPC1
SCHEMBL29730373 0.76 ASIC3 (0.65) ASIC3MIFKMOSMN1; SMN2NPC1

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
US-8771843-B2 Fluorene derivative, organic compound, and light-emitting element, light-emitting device, and electronic device using the compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-07-08 US disclosed
US-20120049768-A1 Fluorene Derivative, Organic Compound, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-01 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 (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-20120049768-A1 Fluorene Derivative, Organic Compound, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Compound AFF2, MAPRE2, AFF4 ASIC3 650/4885MIF 2980/4885KMO 1805/4885

“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.