SCHEMBL22483141

SCHEMBL22483141

c1ccc2c(c1)ccc1c3ncncc3oc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.42
CYP1A1 P04798 5/20 0.42
CYP1B1 Q16678 5/20 0.42
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 5/20 0.40
KMT2A Q03164 2/20 0.40
PRKDC P78527 2/20 0.40
POLB P06746 1/20 0.40
CFTR P13569 1/20 0.40
LIMK1 P53667 1/20 0.40
HPGD P15428 7/20 0.37
ALDH1A1 P00352 6/20 0.37
MAPT P10636 5/20 0.37
HSD17B10 Q99714 2/20 0.37
HTT P42858 2/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL30356598 1.00 CYP1A2 (0.42) CYP1A2CYP1A1CYP1B1CYP2C9CYP2C19
SCHEMBL30075707 0.79 AHR (0.43) CYP1A2CYP1A1CYP2C9CYP2C19NPC1
SCHEMBL22476343 0.79 AHR (0.43) CYP1A2CYP1A1CYP2C9CYP2C19NPC1
SCHEMBL21030536 0.78 CYP1A2 (0.47) CYP1A2CYP1A1CYP1B1CYP2C9CYP2C19
SCHEMBL483929 0.76 SMN1; SMN2 (0.51) CYP1A2CYP2C9CYP2C19NPC1RAB9A
SCHEMBL21398140 0.76 SMN1; SMN2 (0.38) CYP1A2CYP2C9CYP2C19NPC1RAB9A
SCHEMBL13509564 0.76 SMN1; SMN2 (0.38) CYP1A2NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL24958331 0.76 CYP1A1 (0.44) CYP1A2CYP1A1CYP1B1CYP2C9CYP2C19
SCHEMBL19758245 0.75 SMN1; SMN2 (0.47) CYP1A2CYP2C9CYP2C19NPC1RAB9A
SCHEMBL18852808 0.75 MAPT (0.51) CYP1A2CYP1A1CYP1B1CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230380280-A1 ORGANIC COMPOUNDS, MIXTURES AND APPLICATIONS THEREOF IN ORGANIC ELECTRONIC DEVICES Zhejiang Brilliant Optoelectronic Technology Co.,Ltd. (CN) 2023-11-23 US disclosed
US-20230357169-A1 ORGANIC COMPOUNDS, MIXTURES, AND USES THEREOF IN ORGANIC ELETRONIC DEVICES Zhejiang Brilliant Optoelectronic Technology Co.,Ltd. (CN) 2023-11-09 US disclosed
US-11760769-B2 Composition and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-19 US disclosed
US-11760769-B2 Composition and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-19 US disclosed
US-20210009616-A1 COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD (KR) 2021-01-14 US disclosed
US-20200308201-A1 COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-10-01 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 (5 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-20230357169-A1 ORGANIC COMPOUNDS, MIXTURES, AND USES THEREOF IN ORGANIC ELETRONIC DEVICES SLCO1B3, SLCO2B1, SLCO2A1 CYP1A2 109/4885CYP1A1 83/4885CYP1B1 100/4885
US-20200308201-A1 COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, LEF1 CYP1A2 47/4885CYP1A1 16/4885CYP1B1 9/4885
US-20210009616-A1 COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SLC39A14, ORC3, TIMM13 CYP1A2 2109/4885CYP1A1 1498/4885CYP1B1 2542/4885
US-11760769-B2 Composition and organic light-emitting device including the same CRY1, CRY2, LEF1 CYP1A2 47/4885CYP1A1 16/4885CYP1B1 9/4885
US-20230380280-A1 ORGANIC COMPOUNDS, MIXTURES AND APPLICATIONS THEREOF IN ORGANIC ELECTRONIC DEVICES OR10J3, AOX1, SLCO4C1 CYP1A2 78/4885CYP1A1 50/4885CYP1B1 57/4885

“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.