SCHEMBL9610871

SCHEMBL9610871

COc1ccc([C@H]2c3[nH]c4ccc(Cl)cc4c3CCN2C(=O)Oc2ccc(C)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.60
MAPT P10636 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.59
ABCG2 Q9UNQ0 9/20 0.56
ABCB1 P08183 6/20 0.56
KIF11 P52732 4/20 0.53
LMNA P02545 3/20 0.52

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
SCHEMBL764818 1.00 TP53 (0.60) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL8403046 0.95 TP53 (0.55) TP53MAPTSMN1; SMN2ABCG2ABCB1
Emvododstat SCHEMBL29965534 0.95 TP53 (0.62) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL15087042 0.95 TP53 (0.62) TP53MAPTSMN1; SMN2ABCG2ABCB1
Emvododstat SCHEMBL29382728 0.95 TP53 (0.62) TP53MAPTSMN1; SMN2ABCG2ABCB1
Emvododstat SCHEMBL764056 0.95 TP53 (0.62) TP53MAPTSMN1; SMN2ABCG2ABCB1
Emvododstat SCHEMBL8509210 0.95 TP53 (0.62) TP53MAPTSMN1; SMN2ABCG2ABCB1
Emvododstat SCHEMBL9962251 0.95 TP53 (0.62) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL22238592 0.95 TP53 (0.54) TP53MAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL8403043 0.95 TP53 (0.60) TP53MAPTSMN1; SMN2ABCG2ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230172915-A1 DHODH INHIBITOR FOR THE TREATMENT OF COVID-19 PTC THERAPEUTICS, INC. (US) 2023-06-08 US disclosed
US-8372860-B2 Carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2013-02-12 US disclosed
US-20120136154-A1 PROCESSES FOR THE PREPARATION OF SUBSTITUTED TETRAHYDRO BETA-CARBOLINES PTC THERAPEUTICS, INC. 2012-05-31 US disclosed
US-8076352-B2 Administration of carboline derivatives useful in the treatment of cancer and other diseases PTC THERAPEUTICS, INC. (US) 2011-12-13 US disclosed
US-20100179132-A1 CARBOLINE DERIVATIVES USEFUL IN THE INHIBITION OF ANGIOGENESIS PTC THERAPEUTICS, INC. 2010-07-15 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 (3 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-20230172915-A1 DHODH INHIBITOR FOR THE TREATMENT OF COVID-19 DHODH, ACE2, DHRS9 TP53 4232/4885MAPT 3213/4885SMN1; SMN2 3429/4885
US-20100179132-A1 CARBOLINE DERIVATIVES USEFUL IN THE INHIBITION OF ANGIOGENESIS VEGFA, FLT4, PGF TP53 166/4885MAPT 4804/4885SMN1; SMN2 4588/4885
US-20120136154-A1 PROCESSES FOR THE PREPARATION OF SUBSTITUTED TETRAHYDRO BETA-CARBOLINES TPH1, TPH2, HTR1B TP53 4290/4885MAPT 1428/4885SMN1; SMN2 1796/4885

“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.