SCHEMBL14770643

SCHEMBL14770643

c1ccc2c(c1)sc1ccc(-c3ccnc(-c4cc(-c5ccc6oc7ccc(-n8c9ccccc9c9ccccc98)cc7c6c5)ccn4)c3)cc12

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
ROCK1 Q13464 1/20 0.31
PTPRF P10586 3/20 0.30
PTPN2 P17706 3/20 0.30
PTPN1 P18031 3/20 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
SCHEMBL14770639 0.88 KDM4E (0.34) NPC1MAPTPTPRFPTPN2PTPN1
SCHEMBL14867938 0.88 KDM4E (0.34) NPC1MAPT
SCHEMBL11987379 0.88 KDM4E (0.34) NPC1MAPT
SCHEMBL14770641 0.88 NPC1 (0.39) NPC1MAPTPTPRFPTPN2PTPN1
SCHEMBL10349396 0.88 KDM4E (0.38) NPC1MAPT
SCHEMBL15781006 0.88 KDM4E (0.38) NPC1MAPT
SCHEMBL15780957 0.88 KDM4E (0.38) NPC1MAPT
SCHEMBL10348780 0.88 KDM4E (0.38) NPC1MAPT
SCHEMBL10042921 0.88 KDM4E (0.38) NPC1MAPT
SCHEMBL16482586 0.87 PLA2G2A (0.36) NPC1MAPT

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-9604972-B2 Nitrogen-containing heteroaromatic ring compound IDEMITSU KOSAN CO., LTD. (JP) 2017-03-28 US disclosed
US-9604972-B2 Nitrogen-containing heteroaromatic ring compound IDEMITSU KOSAN CO., LTD. (JP) 2017-03-28 US disclosed
US-20130062597-A1 NITROGEN-CONTAINING HETEROAROMATIC RING COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2013-03-14 US disclosed
US-20130062597-A1 NITROGEN-CONTAINING HETEROAROMATIC RING COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2013-03-14 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-20130062597-A1 NITROGEN-CONTAINING HETEROAROMATIC RING COMPOUND TDO2, AHR, NOC2L NPC1 3134/4885MAPT 2242/4885ROCK1 3449/4885

“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.