SCHEMBL9961950

SCHEMBL9961950

COC(=O)N1CCc2c([nH]c3ccc(C)cc23)[C@@H]1c1ccc(C)cc1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 10/20 0.63
TP53 P04637 5/20 0.60
LMNA P02545 4/20 0.60
MAPT P10636 3/20 0.59
ABCG2 Q9UNQ0 1/20 0.59
POLB P06746 1/20 0.56

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
SCHEMBL9961949 1.00 KIF11 (0.63) KIF11TP53LMNAMAPTABCG2
SCHEMBL9961948 0.94 KIF11 (0.72) KIF11TP53LMNAMAPTABCG2
SCHEMBL8402610 0.94 KIF11 (0.72) KIF11TP53LMNAMAPTABCG2
SCHEMBL4928041 0.92 KIF11 (0.57) KIF11TP53LMNAMAPTABCG2
SCHEMBL4924334 0.92 LMNA (0.56) KIF11TP53LMNAMAPTABCG2
SCHEMBL765163 0.92 TP53 (0.55) KIF11TP53LMNAMAPTABCG2
SCHEMBL764793 0.86 TP53 (0.58) KIF11TP53LMNAMAPTABCG2
SCHEMBL11912922 0.86 TP53 (0.64) KIF11TP53LMNAMAPTABCG2
SCHEMBL14678935 0.84 TP53 (0.58) KIF11TP53LMNAMAPTABCG2
SCHEMBL11912895 0.83 KIF11 (0.59) KIF11TP53MAPTABCG2

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
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2016-11-24 US disclosed
US-9351964-B2 Methods for treating cancer and non-neoplastic conditions PTC THERAPEUTICS, INC. (US) 2016-05-31 US disclosed
US-8703726-B2 Methods for treating prostate conditions PTC THERAPEUTICS, INC. (US) 2014-04-22 US disclosed
US-20130171103-A1 METHODS FOR TREATING VIRAL CONDITIONS PTC THERAPEUTICS, INC. (US) 2013-07-04 US disclosed
US-20120202801-A1 METHODS FOR TREATING BREAST CANCER PTC THERAPEUTICS, INC. 2012-08-09 US disclosed
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC (US) 2012-08-09 US disclosed
US-20120178707-A1 METHODS FOR TREATING PROSTRATE CONDITIONS PTC THERAPEUTICS, INC. 2012-07-12 US disclosed
US-20120157400-A1 METHODS FOR TREATING KAPOSI SARCOMA PTC THERAPEUTICS, INC. 2012-06-21 US disclosed
US-20120157401-A1 METHODS FOR TREATING NEUROFIBROMATOSIS PTC THERAPEUTICS, INC. 2012-06-21 US disclosed
US-20120157402-A1 METHODS FOR TREATING BRAIN TUMORS PTC THERAPEUTICS, INC. 2012-06-21 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 (8 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-20120157402-A1 METHODS FOR TREATING BRAIN TUMORS HDGF, VEGFA, FLT4 KIF11 1658/4885TP53 61/4885LMNA 3379/4885
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA KIF11 2569/4885TP53 16/4885LMNA 1803/4885
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA KIF11 2569/4885TP53 16/4885LMNA 1803/4885
US-20120157401-A1 METHODS FOR TREATING NEUROFIBROMATOSIS VHL, NGF, VEGFA KIF11 1626/4885TP53 99/4885LMNA 1622/4885
US-20130171103-A1 METHODS FOR TREATING VIRAL CONDITIONS EIF2AK2, POLRMT, POLM KIF11 2855/4885TP53 156/4885LMNA 1455/4885
US-20120157400-A1 METHODS FOR TREATING KAPOSI SARCOMA HDGF, HIF1AN, VEGFA KIF11 1065/4885TP53 17/4885LMNA 1893/4885
US-20120202801-A1 METHODS FOR TREATING BREAST CANCER VEGFA, FLT4, FLT1 KIF11 1215/4885TP53 34/4885LMNA 3985/4885
US-20120178707-A1 METHODS FOR TREATING PROSTRATE CONDITIONS ACP3, BPHL, PTGFR KIF11 1310/4885TP53 380/4885LMNA 2939/4885

“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.