SCHEMBL19862124

SCHEMBL19862124

Cc1cc(-c2ccccc2)nc(-c2cnc(-c3ccccc3)nc2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
MEN1 O00255 6/20 0.49
KMT2A Q03164 6/20 0.49
MAPT P10636 2/20 0.49
HPGD P15428 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ABCG2 Q9UNQ0 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
MAPK1 P28482 1/20 0.49
CYP2C19 P33261 1/20 0.49
ATM Q13315 1/20 0.49
ADORA2A P29274 1/20 0.49
ADORA1 P30542 1/20 0.49

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
SCHEMBL1104801 0.89 LMNA (0.66) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL16922505 0.85 LMNA (0.61) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL16373471 0.85 LMNA (0.61) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL25491455 0.85 LMNA (0.61) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL16376450 0.85 LMNA (0.61) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18624157 0.83 LMNA (0.57) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL19164369 0.82 MEN1 (0.61) LMNANPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL19164654 0.82 MEN1 (0.61) LMNANPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL16376436 0.81 LMNA (0.56) LMNANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL1104806 0.81 LMNA (0.56) LMNANPC1RAB9ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10693075-B2 Spiro compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2020-06-23 US disclosed
US-20180155312-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2018-06-07 US disclosed
US-20180159045-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2018-06-07 US disclosed
US-20180047907-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2018-02-15 US disclosed
US-20180047918-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2018-02-15 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 (4 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-10693075-B2 Spiro compound and organic electronic device comprising the same ESRRA, REN, ESRRB LMNA 3761/4885NPC1 3562/4885RAB9A 495/4885
US-20180047918-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME ORC3, AOX1, RCOR3 LMNA 4731/4885NPC1 4499/4885RAB9A 450/4885
US-20180047907-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME CNKSR1, CBX4, RBX1 LMNA 4344/4885NPC1 4226/4885RAB9A 482/4885
US-20180155312-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME SOD1, SCO2, RCOR3 LMNA 4698/4885NPC1 4753/4885RAB9A 385/4885

“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.