SCHEMBL19368665

SCHEMBL19368665

BC(C)(C)c1ccc2ccccc2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
NCF1 P14598 3/20 0.45
NOS2 P35228 1/20 0.43
BACE1 P56817 1/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
SSTR4 P31391 1/20 0.41
AHR P35869 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
ACHE P22303 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MGAM O43451 1/20 0.38
PLA2G1B P04054 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
PTGS2 P35354 1/20 0.38
LMNA P02545 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.38

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
SCHEMBL762342 0.83 CYP1A2 (0.52) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL30824476 0.83 CYP1A2 (0.52) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL18464484 0.79 CYP1A2 (0.48) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL30824515 0.79 CYP1A2 (0.48) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL29078300 0.79 CYP1A2 (0.48) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL10773584 0.79 CYP1A2 (0.48) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL4379182 0.79 NCF1 (0.48) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL13194994 0.76 CYP1A2 (0.45) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL30824473 0.76 CYP1A2 (0.45) CYP1A2NCF1NOS2BACE1CA12
SCHEMBL28783629 0.76 CYP1A2 (0.45) CYP1A2NCF1NOS2BACE1CA12

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-9951010-B2 Compounds as CRTH2 antagonist and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2018-04-24 US disclosed
US-20170267634-A1 COMPOUNDS AS CRTH2 ANTAGONIST AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-09-21 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-20170267634-A1 COMPOUNDS AS CRTH2 ANTAGONIST AND USES THEREOF HRH2, PTGDR2, HRH1 CYP1A2 308/4885NCF1 2335/4885NOS2 717/4885

“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.