SCHEMBL20156188

SCHEMBL20156188

N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1-n1c2ccc(C(F)(F)F)cc2c2cc(C(F)(F)F)ccc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 7/20 0.41
DHODH Q02127 1/20 0.36
CTSS P25774 2/20 0.36
CTSK P43235 1/20 0.36
ALDH1A1 P00352 3/20 0.35
TAS2R14 Q9NYV8 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
DPP4 P27487 1/20 0.35
KIF11 P52732 1/20 0.34
AR P10275 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 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
SCHEMBL20114666 0.97 ABCG2 (0.39) ABCG2DHODHCTSSCTSKALDH1A1
SCHEMBL20114996 0.90 AR (0.41) ABCG2ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL20150297 0.90 ABCG2 (0.38) ABCG2ALDH1A1SMN1; SMN2KDM4EHTT
SCHEMBL20150336 0.88 ALDH1A1 (0.40) ABCG2ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL22243210 0.88 ABCG2 (0.36) ABCG2DHODHCTSSCTSKALDH1A1
SCHEMBL21108368 0.88 ABCG2 (0.39) ABCG2DHODHCTSSCTSKKDM4E
SCHEMBL20114993 0.88 ABCG2 (0.35) ABCG2CTSSCTSKAR
SCHEMBL20114994 0.88 AR (0.39) ABCG2ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL20114511 0.87 ABCG2 (0.38) ABCG2ALDH1A1SMN1; SMN2LMNA
SCHEMBL21108810 0.87 ABCG2 (0.39) ABCG2DHODHCTSSCTSKALDH1A1

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-10421746-B2 Organic molecules, especially for use in organic optoelectronic devices CYNORA GMBH (DE) 2019-09-24 US disclosed
US-20180134686-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-05-17 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 (2 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-20180134686-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, EPCAM, F12 ABCG2 2585/4885DHODH 2975/4885CTSS 4539/4885
US-10421746-B2 Organic molecules, especially for use in organic optoelectronic devices OR10J3, EPCAM, F12 ABCG2 2585/4885DHODH 2975/4885CTSS 4539/4885

“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.