SCHEMBL21022955

SCHEMBL21022955

Cc1ccc(-c2ccccn2)cc1-c1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.49
KDM4E B2RXH2 2/20 0.49
CYP1A2 P05177 2/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
CCR1 P32246 1/20 0.46
CCR5 P51681 1/20 0.46
CCR8 P51685 1/20 0.46
METAP1 P53582 1/20 0.46
BLM P54132 1/20 0.46
HIF1A Q16665 1/20 0.46
DOHH Q9BU89 1/20 0.46
P4HTM Q9NXG6 1/20 0.46
RET P07949 1/20 0.45
RIPK1 Q13546 1/20 0.45
RIPK3 Q9Y572 1/20 0.45
PKM P14618 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL21742630 0.89 MAPK14 (0.48) NPC1KDM4ECYP1A2LMNAPOLB
SCHEMBL18657149 0.89 NPC1 (0.46) NPC1KDM4ECYP1A2LMNAPOLB
SCHEMBL18571558 0.88 BTK (0.49) NPC1KDM4ECYP1A2LMNAPOLB
SCHEMBL17086997 0.86 TGFBR1 (0.46) NPC1KDM4ECYP1A2LMNAPOLB
SCHEMBL18174568 0.86 RET (0.44) NPC1KDM4ECYP1A2LMNAPOLB
SCHEMBL18174571 0.86 NPC1 (0.44) NPC1KDM4ECYP1A2LMNAPOLB
SCHEMBL4769511 0.85 CHEK2 (0.46) NPC1KDM4ECYP1A2LMNAPOLB
SCHEMBL15588885 0.85 GRM5 (0.52) NPC1KDM4EMEN1KMT2ATGFBR1
SCHEMBL16882962 0.85 GRM5 (0.43) NPC1KDM4ECYP1A2LMNAPOLB
SCHEMBL7662434 0.85 KDM4E (0.56) NPC1KDM4ECYP1A2LMNAPOLB

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-11168103-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2021-11-09 US disclosed
US-20190153009-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2019-05-23 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 (2 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-20190153009-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES CHRM4, CHRM1, OPRD1 NPC1 1191/4885KDM4E 2325/4885CYP1A2 620/4885
US-11168103-B2 Organic electroluminescent materials and devices OCIAD1, OCIAD2, OR10J3 NPC1 2253/4885KDM4E 2935/4885CYP1A2 2400/4885

“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.