SCHEMBL23910121

SCHEMBL23910121

N#Cc1cc(N)ccc1-c1ccc(C(F)F)nc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 3/20 0.41
▸ FEN1 P39748 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP11B2 P19099 3/20 0.36
▸ CYP11B1 P15538 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ ABL1 P00519 1/20 0.35
▸ AAK1 Q2M2I8 2/20 0.34
▸ PIK3CD O00329 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ MAP4K4 O95819 1/20 0.32
▸ EGLN2 Q96KS0 1/20 0.32

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
SCHEMBL23909979 0.81 AAK1 (0.44) ALOX5APFEN1KDM4ELMNACYP11B2
SCHEMBL23909957 0.78 KDM4E (0.41) ALOX5APFEN1KDM4EALDH1A1USP2
SCHEMBL26926454 0.78 VCAM1 (0.45) ALOX5APFEN1KDM4ELMNAALDH1A1
SCHEMBL21071606 0.78 ALOX5AP (0.46) ALOX5APFEN1PIK3CDMAP4K4
SCHEMBL23910065 0.76 ALOX5AP (0.41) ALOX5APFEN1KDM4ECYP11B2CYP11B1
SCHEMBL20329653 0.75 KDM4E (0.49) KDM4EALDH1A1USP2PIK3CD
SCHEMBL23909947 0.75 KDM1A (0.43) ALOX5APFEN1KDM4ECYP11B2CYP11B1
SCHEMBL30101062 0.75 KDM4E (0.48) ALOX5APFEN1KDM4ELMNACYP11B2
SCHEMBL23910057 0.75 KDM4E (0.44) ALOX5APFEN1KDM4ELMNACYP11B2
SCHEMBL20329860 0.75 PIK3CA (0.44) ALOX5APFEN1KDM4ECYP11B2CYP11B1

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-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-10-14 — — US disclosed
US-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-10-14 — — 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-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS TSLP, IL5, TRPA1 ALOX5AP 419/4885FEN1 4761/4885KDM4E 4547/4885

“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.

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