SCHEMBL19658684

SCHEMBL19658684

CN1CCN(CCNC(=O)c2cn(Cc3c[nH]c4c(=O)n(C)cc(C(=O)NCCCN5CCOCC5)c34)c(=O)c3[nH]ccc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TAF1 P21675 2/20 0.45
▸ CECR2 Q9BXF3 2/20 0.45
▸ BRD9 Q9H8M2 1/20 0.45
▸ HPGD P15428 3/20 0.45
▸ BRD4 O60885 2/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ SMYD2 Q9NRG4 1/20 0.38
▸ GAA P10253 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37

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
SCHEMBL17753996 0.84 TAF1 (0.56) TAF1CECR2BRD9HPGDBRD4
SCHEMBL17753997 0.82 TAF1 (0.64) TAF1CECR2BRD9HPGDBRD4
SCHEMBL17753895 0.82 TAF1 (0.58) TAF1CECR2BRD9HPGDBRD4
SCHEMBL17753983 0.80 BRD9 (0.66) TAF1CECR2BRD9HPGDBRD4
SCHEMBL19658678 0.76 BRD9 (0.49) TAF1CECR2BRD9BRD4
SCHEMBL17753910 0.75 TAF1 (0.54) TAF1CECR2BRD9BRD4
SCHEMBL17753900 0.73 BRD9 (0.60) TAF1CECR2BRD9HPGDBRD4
SCHEMBL17753907 0.73 TAF1 (0.55) TAF1CECR2BRD9BRD4
SCHEMBL17753985 0.72 CECR2 (0.60) TAF1CECR2BRD9HPGDBRD4
SCHEMBL19658618 0.72 TAF1 (0.49) TAF1CECR2BRD9HPGDBRD4

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-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 — — US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 — — 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-10258603-B2 Therapeutic compounds and uses thereof BRD4, BRDT, BRD3 TAF1 439/4885CECR2 184/4885BRD9 16/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 TAF1 439/4885CECR2 184/4885BRD9 16/4885

“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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