SCHEMBL2475963

SCHEMBL2475963

Brc1csc2c(NCCCN3CCCC3)ncnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.41
▸ LMNA P02545 5/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ PIM1 P11309 2/20 0.41
▸ ALDH1A1 P00352 7/20 0.40
▸ USP2 O75604 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HTT P42858 2/20 0.40
▸ KDM4E B2RXH2 5/20 0.39
▸ HPGD P15428 3/20 0.39
▸ POLB P06746 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ PGK1 P00558 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ IDE P14735 1/20 0.38
▸ ACP1 P24666 1/20 0.37
▸ HRH3 Q9Y5N1 2/20 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
SCHEMBL2478712 0.80 LMNA (0.47) LMNASMN1; SMN2ALDH1A1USP2TSHR
SCHEMBL15214860 0.80 LMNA (0.52) LMNASMN1; SMN2ALDH1A1USP2TSHR
SCHEMBL24927432 0.79 CHEK2 (0.46) LMNASMN1; SMN2ALDH1A1TSHRHTT
SCHEMBL10359775 0.78 LMNA (0.46) LMNASMN1; SMN2ALDH1A1USP2TSHR
SCHEMBL30092872 0.76 PDE4A (0.50) EGFRLMNASMN1; SMN2ALDH1A1HTT
SCHEMBL3930470 0.68 FLT1 (0.52) EGFRLMNASMN1; SMN2ALDH1A1USP2
SCHEMBL15051728 0.68 RAB9A (0.47) EGFRALDH1A1KDM4EHSD17B10MEN1
SCHEMBL2476576 0.66 LMNA (0.43) EGFRLMNASMN1; SMN2HTT
SCHEMBL18373434 0.65 ALDH1A1 (0.42) EGFRLMNAALDH1A1USP2TSHR
SCHEMBL47768 0.65 PIM1 (0.45) EGFRPIM1PGK1ACP1HRH3

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373163-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2015-06-10 — — EP disclosed
EP-2373163-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2015-06-10 — — EP disclosed
US-8232273-B2 Heterocyclic compounds and methods of use GENENTECH, INC. (US) 2012-07-31 — — US disclosed
US-8232273-B2 Heterocyclic compounds and methods of use GENENTECH, INC. (US) 2012-07-31 — — US disclosed
US-8232273-B2 Heterocyclic compounds and methods of use GENENTECH, INC. (US) 2012-07-31 — — US disclosed
EP-2373163-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2011-10-12 — — EP disclosed
US-20100210622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-08-19 — — US disclosed
US-20100210622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-08-19 — — US disclosed
US-20100210622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-08-19 — — US disclosed
WO-2010080503-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2010-07-15 — — WO 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-20100210622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE BCL2A1, BAX, BCL2 EGFR 2847/4885LMNA 97/4885SMN1; SMN2 981/4885

“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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