SCHEMBL25501416

SCHEMBL25501416

Clc1ccc(-c2c(Cl)cccc2Br)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
AHR P35869 2/20 0.37
GRM2 Q14416 1/20 0.37
CNR1 P21554 1/20 0.37
KDM4E B2RXH2 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP2A6 P11509 2/20 0.35
LMNA P02545 1/20 0.35
GRIA1 P42261 1/20 0.34
CACNG8 Q8WXS5 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
CASP3 P42574 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
SCHEMBL26191585 0.85 ALDH1A1 (0.44) CYP1A2CYP2A6LMNANPC1ALDH1A1
SCHEMBL11454164 0.84 MAPK1 (0.44) CYP1A2KDM4ECYP2A6LMNAALDH1A1
SCHEMBL4456487 0.84 CYP1A2 (0.50) CYP1A2AHRCNR1KDM4ENPSR1
SCHEMBL25463605 0.79 JAK2 (0.47) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL3569291 0.79 ALOX5 (0.41) CNR1GRIA1CACNG8NPC1TP53
SCHEMBL25893532 0.78 ALOX5 (0.44) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL30523573 0.76 ALDH1A1 (0.52) CYP1A2CYP3A4CYP2C9KDM4ECYP2A6
SCHEMBL3570866 0.75 GRIA1 (0.42) GRIA1CACNG8ALDH1A1TP53FABP4
SCHEMBL25587639 0.75 GRIA1 (0.39) CYP1A2CYP2C9CYP2C19KDM4ENPSR1
SCHEMBL2850180 0.75 FABP3 (0.49) CYP1A2CNR1KDM4ECYP2A6GRIA1

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 CYP1A2 1293/4885CYP3A4 1547/4885CYP2D6 1540/4885

“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.