SCHEMBL29293263

SCHEMBL29293263

Clc1ccc(-c2ccc(-c3ccccc3)nc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.60
MAP4K4 O95819 1/20 0.53
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
GAA P10253 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
HPGDS O60760 1/20 0.50
CTRC Q99895 1/20 0.49
ALDH1A1 P00352 1/20 0.47
ALDH1A3 P47895 1/20 0.47
KDM1A O60341 1/20 0.47
MAOB P27338 1/20 0.47
SCN2A Q99250 1/20 0.47
LDHA P00338 1/20 0.47
HSD17B1 P14061 1/20 0.46
HSD17B2 P37059 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL26598034 0.90 CYP1A2 (0.56) CYP1A2MAP4K4NPC1RAB9ASMN1; SMN2
SCHEMBL913315 0.89 HPGDS (0.58) NPC1RAB9ASMN1; SMN2HPGDSALDH1A1
SCHEMBL903715 0.89 HPGDS (0.58) NPC1RAB9ASMN1; SMN2HPGDSALDH1A1
SCHEMBL29578423 0.89 HPGDS (0.58) NPC1RAB9ASMN1; SMN2HPGDSALDH1A1
SCHEMBL12523550 0.89 HPGDS (0.58) NPC1RAB9ASMN1; SMN2HPGDSALDH1A1
SCHEMBL25118611 0.89 HPGDS (0.58) NPC1RAB9ASMN1; SMN2HPGDSALDH1A1
Iodide SCHEMBL30978328 0.87 HPGDS (0.56) NPC1RAB9ASMN1; SMN2HPGDSLDHA
SCHEMBL30471908 0.87 HPGDS (0.56) NPC1RAB9ASMN1; SMN2HPGDSLDHA
SCHEMBL500158 0.87 HPGDS (0.56) NPC1RAB9ASMN1; SMN2HPGDSLDHA
SCHEMBL12973036 0.87 HPGDS (0.60) NPC1RAB9ASMN1; 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
US-20240228470-A1 Organic Compound And Organic Light Emitting Device Including Same P&H TECH CO., LTD (KR) 2024-07-11 US disclosed
US-20240228470-A1 Organic Compound And Organic Light Emitting Device Including Same P&H TECH CO., LTD (KR) 2024-07-11 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-20240228470-A1 Organic Compound And Organic Light Emitting Device Including Same OR10J3, ORMDL3, OR51E2 CYP1A2 609/4885MAP4K4 4021/4885NPC1 1172/4885

“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.