SCHEMBL3684937

SCHEMBL3684937

CCc1ccccc1P(c1ccccc1CC)[C@@H]1CCCC[C@H]1P(c1ccccc1CC)c1ccccc1CC

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
TSHR P16473 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 1/20 0.36
CTSB P07858 1/20 0.34
LMNA P02545 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB2 P47870 2/20 0.33
TP53 P04637 1/20 0.33
ALOX5 P09917 1/20 0.32
HDAC4 P56524 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
SCHEMBL3674763 1.00 KMT2A (0.39) KMT2ATSHRHSD17B10MAPTCTSB
SCHEMBL3680130 1.00 KMT2A (0.39) KMT2ATSHRHSD17B10MAPTCTSB
SCHEMBL3680128 1.00 KMT2A (0.39) KMT2ATSHRHSD17B10MAPTCTSB
SCHEMBL16694657 0.78 KMT2A (0.39) KMT2ATSHRHSD17B10CTSBLMNA
SCHEMBL27770082 0.75 KMT2A (0.40) KMT2ATSHRHSD17B10CTSBLMNA
SCHEMBL16695057 0.73 KMT2A (0.35) KMT2ATSHRHSD17B10MAPTCTSB
SCHEMBL2353175 0.71 KMT2A (0.45) KMT2ATSHRHSD17B10CTSBLMNA
SCHEMBL29790848 0.71 GABRA1 (0.44) MAPTLMNAGABRA1GABRB2TP53
SCHEMBL2340745 0.71 GABRA1 (0.44) MAPTLMNAGABRA1GABRB2TP53
SCHEMBL3676533 0.70 CA1 (0.43) TSHRLMNATP53

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-8309779-B2 Ethylene oligomerization catalyst systems having enhanced selectivity SK INNOVATION CO., LTD. (KR) 2012-11-13 US disclosed
US-20100145124-A1 ETHEYENE OLIGOMERIZA CATALYST SYSTEMS HAVING ENEHANCED SELECTIVITY SK INNOVATION CO., LTD. (KR) 2010-06-10 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-20100145124-A1 ETHEYENE OLIGOMERIZA CATALYST SYSTEMS HAVING ENEHANCED SELECTIVITY CBR3, ESR2, ESR1 KMT2A 2536/4885TSHR 517/4885HSD17B10 3890/4885

“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.