SCHEMBL22791037

SCHEMBL22791037

Oc1ccccc1-c1cc2c(C3CCN(c4cc(C5CCNCC5)ncn4)CC3)c[nH]c2nn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PBRM1 Q86U86 7/20 0.40
▸ SMARCA2 P51531 5/20 0.40
▸ SMARCA4 P51532 5/20 0.40
▸ IKBKB O14920 2/20 0.38
▸ CYP1A2 P05177 2/20 0.37
▸ CYP2C19 P33261 1/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ ADRB2 P07550 1/20 0.35
▸ NR1I2 O75469 2/20 0.34
▸ CHUK O15111 1/20 0.33
▸ CAMKK2 Q96RR4 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ OPRL1 P41146 1/20 0.33
▸ TAF1 P21675 1/20 0.32
▸ CECR2 Q9BXF3 1/20 0.32
▸ BRD9 Q9H8M2 1/20 0.32
▸ LRRK2 Q5S007 1/20 0.32
▸ APP P05067 1/20 0.32
▸ KDM4E B2RXH2 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
SCHEMBL22777062 0.86 IKBKB (0.48) PBRM1SMARCA2SMARCA4IKBKBHTR2C
SCHEMBL29619417 0.86 IKBKB (0.48) PBRM1SMARCA2SMARCA4IKBKBHTR2C
SCHEMBL25468683 0.84 SMARCA2 (0.49) PBRM1SMARCA2SMARCA4
SCHEMBL22777840 0.84 PBRM1 (0.39) PBRM1SMARCA2SMARCA4IKBKBHTR2C
SCHEMBL24461294 0.80 IKBKB (0.44) PBRM1SMARCA2SMARCA4IKBKBHTR2C
SCHEMBL22790943 0.78 CYP1A2 (0.49) PBRM1SMARCA2SMARCA4CYP1A2APP
SCHEMBL22777839 0.77 PBRM1 (0.41) PBRM1SMARCA2SMARCA4NR1I2CAMKK2
SCHEMBL24461290 0.75 PBRM1 (0.40) PBRM1SMARCA2SMARCA4IKBKBNR1I2
SCHEMBL30552534 0.75 PBRM1 (0.40) PBRM1SMARCA2SMARCA4IKBKBNR1I2
SCHEMBL25467865 0.75 PBRM1 (0.40) PBRM1SMARCA2SMARCA4IKBKBCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-18 — — US disclosed
US-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-18 — — US disclosed
WO-2020251972-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-17 — — 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-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF SMARCA1, SMARCB1, SMARCE1 PBRM1 5/4885SMARCA2 6/4885SMARCA4 7/4885

“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.

Send feedback