SCHEMBL7127645

SCHEMBL7127645

CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@]2(O)[C@H](O)CC2C[C@@H](O)CC[C@@]21C

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ INPP5D Q92835 1/20 0.55
▸ CYP8B1 Q9UNU6 1/20 0.55
▸ USP2 O75604 4/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ PLA2G1B P04054 1/20 0.52
▸ CDC25A P30304 5/20 0.50
▸ CDC25B P30305 5/20 0.50
▸ NPC1L1 Q9UHC9 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ GPBAR1 Q8TDU6 5/20 0.48
▸ NR1H4 Q96RI1 2/20 0.48

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
SCHEMBL7127648 1.00 INPP5D (0.55) INPP5DCYP8B1USP2MEN1KMT2A
SCHEMBL16226832 0.88 INPP5D (0.57) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL16225939 0.87 USP2 (0.52) CYP8B1USP2MEN1KMT2ALMNA
SCHEMBL16226084 0.87 USP2 (0.52) CYP8B1USP2MEN1KMT2ALMNA
SCHEMBL18541413 0.86 INPP5D (0.73) INPP5DCYP8B1USP2MEN1KMT2A
SCHEMBL6560618 0.85 INPP5D (0.62) INPP5DCYP8B1USP2MEN1KMT2A
SCHEMBL6560622 0.85 INPP5D (0.62) INPP5DCYP8B1USP2MEN1KMT2A
SCHEMBL4247041 0.83 PLA2G1B (0.60) INPP5DCYP8B1USP2MEN1KMT2A
SCHEMBL24103972 0.82 INPP5D (0.64) INPP5DCYP8B1USP2MEN1KMT2A
SCHEMBL18071943 0.76 GPBAR1 (0.74) CYP8B1MEN1KMT2ALMNAGPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030032824-A1 Meiosis regulating compounds GRONDAHL CHRISTIAN (DK) 2003-02-13 — — 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-20030032824-A1 Meiosis regulating compounds MNS1, NR5A1, NASP INPP5D 2986/4885CYP8B1 438/4885USP2 4505/4885

“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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