SCHEMBL25501474

SCHEMBL25501474

Clc1ccc(-c2cc(-c3cccc4ccccc34)ccc2Br)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 5/20 0.44
SERPINE1 P05121 1/20 0.40
EDNRB P24530 2/20 0.39
EDNRA P25101 2/20 0.39
CYP1A2 P05177 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MCL1 Q07820 1/20 0.39
ACMSD Q8TDX5 1/20 0.39
CA12 O43570 3/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA9 Q16790 3/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
GUSB P08236 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
SCHEMBL26279937 0.83 SERPINE1 (0.42) SERPINE1CYP1A2KDM4EALDH1A1CYP2C19
SCHEMBL27354585 0.81 CYP1A2 (0.49) SERPINE1EDNRBEDNRACYP1A2KDM4E
SCHEMBL25501471 0.79 NPSR1 (0.46) EDNRBEDNRACYP1A2KDM4EALDH1A1
SCHEMBL31602534 0.77 CYP1A2 (0.52) SERPINE1EDNRBEDNRACYP1A2KDM4E
SCHEMBL27354595 0.77 CYP1A2 (0.51) EDNRBEDNRACYP1A2KDM4EALDH1A1
SCHEMBL24377404 0.76 CYP2A6 (0.55) SERPINE1CYP1A2KDM4EALDH1A1CYP2C19
SCHEMBL12367187 0.76 CYP1A2 (0.41) CRHR1SERPINE1CYP1A2KDM4EALDH1A1
SCHEMBL16424727 0.75 AHR (0.45) CRHR1CYP1A2KDM4EALDH1A1CYP2C19
SCHEMBL29247946 0.74 CA12 (0.51) EDNRBEDNRAKDM4EALDH1A1RAB9A
SCHEMBL24748359 0.74 CYP1A2 (0.49) SERPINE1EDNRBEDNRACYP1A2KDM4E

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-11655206-B2 Nitrogen-containing compound, electronic element, and electronic device SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-05-23 US disclosed
US-11655206-B2 Nitrogen-containing compound, electronic element, and electronic device SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-05-23 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 (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-11655206-B2 Nitrogen-containing compound, electronic element, and electronic device MNS1, NOS1, NPM1 CRHR1 4490/4885SERPINE1 4298/4885EDNRB 391/4885

“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.