SCHEMBL19982698

SCHEMBL19982698

CC(CI)n1c2ccccc2c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
ATM Q13315 2/20 0.40
TSHR P16473 2/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
BACE1 P56817 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 2/20 0.38
POLB P06746 2/20 0.36
CYP19A1 P11511 1/20 0.36
DNM1 Q05193 2/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL4552430 0.83 GPR3 (0.46) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL18404644 0.81 GPR3 (0.44) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL127116 0.81 GPR3 (0.44) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL14164189 0.81 GPR3 (0.44) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL18258637 0.79 BACE1 (0.44) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL16984870 0.79 BACE1 (0.44) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL20841225 0.78 GPR3 (0.41) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL13772400 0.78 CNR1 (0.43) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL27707046 0.76 GPR3 (0.48) GPR3CYP1A2CYP2C19BCHEACHE
SCHEMBL150044 0.75 BCHE (0.59) GPR3CYP1A2CYP2C19BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022210268-A1 RESIN COMPOSITION, FILM, AND COPOLYMER 住友化学株式会社 2022-10-06 WO disclosed
US-10434102-B2 Organic light emitting device SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2019-10-08 US disclosed
US-20180078554-A1 ORGANIC LIGHT EMITTING DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2018-03-22 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-20180078554-A1 ORGANIC LIGHT EMITTING DEVICE OGFOD1, RAB5IF, OCIAD1 GPR3 2666/4885CYP1A2 1323/4885CYP2C19 864/4885
US-10434102-B2 Organic light emitting device OGFOD1, RAB5IF, OCIAD1 GPR3 2666/4885CYP1A2 1323/4885CYP2C19 864/4885

“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.