SCHEMBL25533993

SCHEMBL25533993

CC1(C)c2ccccc2-c2cc(-c3ccc(-c4nc(-c5ccccc5)cc(-c5ccc6ccccc6c5)n4)c4ccccc34)ccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.45
CYP1B1 Q16678 1/20 0.45
CTRC Q99895 1/20 0.39
CYP1A2 P05177 2/20 0.38
PIM1 P11309 1/20 0.36
MEN1 O00255 6/20 0.36
KMT2A Q03164 6/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPT P10636 3/20 0.36
HPGD P15428 3/20 0.36
ACACA Q13085 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
KDM4E B2RXH2 3/20 0.35
LMNA P02545 2/20 0.35
GLA P06280 1/20 0.35
RAC1 P63000 2/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34

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
SCHEMBL25534001 0.99 CYP1A1 (0.44) CYP1A1CYP1B1CTRCCYP1A2PIM1
SCHEMBL25533711 0.95 CYP1A1 (0.47) CYP1A1CYP1B1CTRCCYP1A2PIM1
SCHEMBL25533717 0.94 CYP1A1 (0.46) CYP1A1CYP1B1CTRCCYP1A2PIM1
SCHEMBL25539332 0.93 CYP1A1 (0.45) CYP1A1CYP1B1CTRCCYP1A2PIM1
SCHEMBL25539354 0.93 CYP1A1 (0.36) CYP1A1CYP1B1CTRCMEN1KMT2A
SCHEMBL25538829 0.93 CYP1A1 (0.36) CYP1A1CYP1B1CTRCMEN1KMT2A
SCHEMBL25539357 0.93 CYP1A1 (0.36) CYP1A1CYP1B1CTRCMEN1KMT2A
SCHEMBL25534011 0.93 MEN1 (0.39) CYP1A1CYP1B1MEN1KMT2AALDH1A1
SCHEMBL25533995 0.93 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL25540285 0.92 CYP1A1 (0.44) CYP1A1CYP1B1CTRCCYP1A2PIM1

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-20230167072-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-06-01 US disclosed
US-20230167072-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-06-01 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 (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-20230167072-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE PIEZO1, LEF1, L1CAM CYP1A1 888/4885CYP1B1 1273/4885CTRC 3942/4885

“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.